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A novel ratiometric NIR fluorescent probe for pH monitoring in live cells and zebrafish 一种用于活细胞和斑马鱼pH监测的新型比例近红外荧光探针
IF 4.2 3区 工程技术 Q2 CHEMISTRY, APPLIED Pub Date : 2025-12-16 DOI: 10.1016/j.dyepig.2025.113506
Xue Yu , Hui Wang , Dan Wang , Yunong Huang , Ding Zhou , Li Fan , Yuewei Zhang
Monitoring pH variations within living organisms is critically important. In this study, we report a novel dual-excitation ratiometric near-infrared (NIR) fluorescent probe (BNClBi–N), which employs hemicyanine dye as the fluorophore. BNClBi–N exhibits a response to pH changes through the protonation and deprotonation of nitrogen atoms on the benzoindole moiety, as confirmed by NMR studies. This protonation modulates the intramolecular charge transfer (ICT) process, causing a significant ratiometric fluorescence emission shift (I700 nm/I610 nm) with a pKa value of 3.46. Additionally, the fluorescent color transitioned from green to yellow within the pH range of 6.0 to 2.0. Additionally, the probe demonstrated good stability and anti-interference capability. Building on these outstanding characteristics, BNClBi–N enabled reliable monitoring exogenous pH in live cells and zebrafish with excellent lysosomal targeting ability.
监测生物体内的pH值变化是至关重要的。在这项研究中,我们报道了一种新的双激发比例近红外(NIR)荧光探针(BNClBi-N),它采用半花青碱染料作为荧光团。通过核磁共振研究证实,BNClBi-N通过苯并吲哚部分上氮原子的质子化和去质子化表现出对pH变化的响应。这种质子化调节了分子内电荷转移(ICT)过程,导致显著的比例荧光发射位移(I700 nm/I610 nm), pKa值为3.46。在pH值6.0 ~ 2.0范围内,荧光颜色由绿色向黄色过渡。此外,该探针具有良好的稳定性和抗干扰能力。基于这些突出的特性,BNClBi-N能够可靠地监测活细胞和斑马鱼的外源pH值,具有出色的溶酶体靶向能力。
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引用次数: 0
Photosensitizer with near-infrared emission employing lysosome as therapeutic target for cancer cell ablation 利用溶酶体作为肿瘤细胞消融治疗靶点的近红外光敏剂
IF 4.2 3区 工程技术 Q2 CHEMISTRY, APPLIED Pub Date : 2025-12-16 DOI: 10.1016/j.dyepig.2025.113505
Bo Lin , Chunxia Liu , Kunyi Zhao , Wenjing Lu , Huan Liu , Chuan Dong , Li Fan
Ferroptosis based on lysosomal lipid peroxidation paves the way for utilizing this pathway as a therapeutic target in photodynamic therapy (PDT). Herein, we constructed an iodine-substituted sulfur-containing lipophilic cationic photosensitizer 2-(2-(5-(4-(di-p-tolylamino)phenyl)thiophen-2-yl)vinyl)-3-ethyl-6-iodobenzo [d]thiazol-3-ium iodide (TTIT) with lysosome-targeting for photoablation of cancer cells. The near infrared (NIR) fluorescence and reactive oxygen species (ROS) generation capacity of TTIT can be specifically activated by low-polarity or high-viscosity environments. Interestingly, the controllable photobleaching behavior of TTIT can prevent excessive phototherapy caused by superfluous light dose. This work confirms that lipid peroxidation-induced lysosomal disruption is a viable strategy for tumor therapy and provides a new photosensitizer that merges high ROS production with self-regulated safety.
基于溶酶体脂质过氧化的铁下垂为利用这一途径作为光动力治疗(PDT)的治疗靶点铺平了道路。在此,我们构建了一种具有溶酶体靶向的碘取代的含硫亲脂性阳离子光敏剂2-(2-(5-(4-(二对苯胺)苯基)噻吩-2-基)乙烯基)-3-乙基-6-碘苯并[d]噻唑-3-碘化铵(TTIT),用于癌细胞的光消融。TTIT的近红外(NIR)荧光和活性氧(ROS)生成能力可在低极性或高粘度环境下特异性激活。有趣的是,TTIT的可控光漂白行为可以防止过量光剂量引起的过度光疗。这项工作证实了脂质过氧化诱导的溶酶体破坏是一种可行的肿瘤治疗策略,并提供了一种新的光敏剂,将高ROS产生与自我调节的安全性结合在一起。
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引用次数: 0
Synergistic end-group chlorination and isomeric thiophene π-bridge strategies achieve near-perfect planarity in non-fused-ring acceptors for efficient organic solar cells 协同端基氯化和同分异构体噻吩π桥策略在高效有机太阳能电池的非融合环受体中实现了近乎完美的平面性
IF 4.2 3区 工程技术 Q2 CHEMISTRY, APPLIED Pub Date : 2025-12-16 DOI: 10.1016/j.dyepig.2025.113502
Zhongxin Zhou , Jun Yang , Shujing Jin , Yongtao zhao , Changheng Guan , Hongjun Wang , Weiguo Zhu , Yu Liu
The ternary strategy, which introduces a third component into the binary system, is a simple and effective method for boosting power conversion efficiency (PCE) of organic solar cells (OSCs). Herein, a novel non-fused-ring small molecule acceptor (NFR-SMA), namely DFTQA-2Cl, featuring a medium bandgap and high planarity, was designed and synthesized through a synergistic strategy combining terminal chlorination and an isomeric thiophene π-bridge. The introduction of DFTQA-2Cl into the D18:Y6 binary system creates a ternary blend with complementary absorptions and cascaded energy alignment, which accelerates exciton dissociation, enhances charge collection, and boosts current density for in high-performance OSCs. Simultaneously, doping modulation via DFTQA-2Cl optimizes the micromorphology and phase separation size of active layer. Based on this, the optimized ternary OSC based on D18:Y6:DFTQA-2Cl achieved a notable PCE of 18.04 %, a 6.68 % enhancement over the 16.91 % of its binary D18:Y6 system, along with simultaneous enhancements in other parameters. Additionally, the ternary OSCs achieved a T80 operational stability of over 1500 h. This work illustrates that incorporating a medium-bandgap NFR-SMA with good planarity as a third component in a binary system effectively enhance the basic parameters of ternary OSCs.
在二元体系中引入第三组分的三元策略是提高有机太阳能电池功率转换效率的一种简单有效的方法。本文采用末端氯化和同分异构体噻吩π桥相结合的协同策略,设计合成了一种中等带隙、高平面度的新型非融合环小分子受体(NFR-SMA) dftka - 2cl。将DFTQA-2Cl引入到D18:Y6二元体系中,形成了具有互补吸收和级联能量排列的三组分混合物,加速了激子解离,增强了电荷收集,并提高了高性能OSCs的电流密度。同时,DFTQA-2Cl掺杂调制优化了活性层的微观形貌和相分离尺寸。在此基础上,优化后的D18:Y6:DFTQA-2Cl三元OSC的PCE为18.04%,比二元D18:Y6体系的16.91%提高了6.68%,其他参数也得到了同步提高。此外,三元osc实现了超过1500小时的T80工作稳定性。本研究表明,在二元体系中加入具有良好平面性的中带隙NFR-SMA作为第三组分,可以有效地提高三元osc的基本参数。
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引用次数: 0
In silico design of anthraquinone-based two-photon photosensitisers for NIR-activated photodynamic therapy in hypoxic tumors 基于蒽醌的双光子光敏剂的硅片设计,用于nir激活光动力治疗缺氧肿瘤
IF 4.2 3区 工程技术 Q2 CHEMISTRY, APPLIED Pub Date : 2025-12-16 DOI: 10.1016/j.dyepig.2025.113507
Maciej Spiegel
A computational methodology is presented for the rational design of anthraquinone-based, heavy-atom–free photosensitisers optimised for two-photon photodynamic therapy in hypoxic tumours within the NIR region. Twelve derivatives were evaluated for two-photon absorption, excited states dynamics, redox reactivity, and ADME properties. Four lead compounds—Oxz, Tdz, Prd, and Pmd—exhibited Herzberg–Teller-enabled intersystem crossing and sufficient triplet-state lifetimes to permit diffusion-limited interactions. The Redox Activity and Chemical Trends Map, validated against Marcus theory, distinguished distinct mechanistic profiles amongst the derivatives, with lead candidates exhibiting selective biomolecular oxidation (Type III). Notably, Pmd retained a reasonable phosphorescence rate despite concurrent processes, indicating likelihood of the sustained Type II reactivity under quenching. SwissADME analysis confirmed favourable permeability and synthetic accessibility. This integrative computational framework—though developed for anthraquinones—is generalisable to diverse scaffolds, facilitating early-stage prioritisation of oxygen-independent, multimodal two–photon PDT candidates for hypoxic cancer treatment.
提出了一种计算方法,用于合理设计基于蒽醌的无重原子光敏剂,该光敏剂优化用于近红外区域内缺氧肿瘤的双光子光动力治疗。对12种衍生物的双光子吸收、激发态动力学、氧化还原反应性和ADME性能进行了评价。四种先导化合物oxz, Tdz, Prd和pmd表现出赫茨伯格-泰勒系统间交叉和足够的三重态寿命,以允许扩散限制相互作用。氧化还原活性和化学趋势图(Redox Activity and Chemical Trends Map)根据Marcus理论进行了验证,在衍生物中区分出不同的机制特征,主要候选衍生物表现出选择性生物分子氧化(III型)。值得注意的是,Pmd保持了合理的磷光率,尽管有并发的过程,这表明在淬火下可能持续II型反应性。SwissADME分析证实了良好的渗透率和合成可达性。这种综合计算框架虽然是为蒽醌类开发的,但可推广到不同的支架,促进缺氧癌症治疗中不依赖氧的多模态双光子PDT候选物的早期优先排序。
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引用次数: 0
Rubus-/Cactus-bioinspired HTC@BiOI/ZnO hierarchical composites for enhanced solar water evaporation, photocatalysis and desalination Rubus-/Cactus-bioinspired HTC@BiOI/ZnO分层复合材料,用于增强太阳能水蒸发,光催化和海水淡化
IF 4.2 3区 工程技术 Q2 CHEMISTRY, APPLIED Pub Date : 2025-12-13 DOI: 10.1016/j.dyepig.2025.113501
Yuping Wu , Xiangbo Yang , Wei Sun , Qianting Wang , Rong Zhang , Fengjuan Yang , Zongli Xie
Addressing the dual challenges of water scarcity and energy demands, solar-driven evaporation systems necessitate breakthroughs in photothermal conversion. However, current technologies encounter inherent limitations to balance efficient light absorption and water transport. Here, we introduces a biomimetic rubus-like architecture comprising hydrothermal carbon (HTC) and a cactus-like BiOI/ZnO composite. The HTC provides broadband solar absorption, while the cactus-like BiOI/ZnO enables efficient light trapping via multi-reflection and established the p-n heterojunction for accelerated charge separation. In addition, the engineered micro-nano rough surface with abundant hydroxyl groups and hydrogen-bonding networks promotes rapid water uptake, transport and evaporation. Benefiting from these synergistic features, the system achieves an outstanding evaporation rate of 6.24 kg·m−2·h−1 and photocatalytic degradation (C/C0) of 30.1 % and rate constants (k) of 0.0185 min−1 under 2.0 sun irradiation. This multifunction design maximizes solar harvesting while preserves catalytically active surface sites, making a significant step towards sustainable solar evaporator technology for integrated water treatment solutions.
为了解决水资源短缺和能源需求的双重挑战,太阳能驱动的蒸发系统需要在光热转换方面取得突破。然而,目前的技术在平衡有效的光吸收和水传输方面遇到了固有的限制。在这里,我们介绍了一种由水热碳(HTC)和仙人掌状BiOI/ZnO复合材料组成的仿生类rubusas结构。HTC提供宽带太阳能吸收,而仙人掌状的BiOI/ZnO通过多次反射实现高效的光捕获,并建立了加速电荷分离的p-n异质结。此外,具有丰富羟基和氢键网络的微纳粗糙表面促进了水分的快速吸收、运输和蒸发。得益于这些协同特性,该体系在2.0太阳照射下的蒸发速率为6.24 kg·m−2·h−1,光催化降解(C/C0)为30.1%,速率常数(k)为0.0185 min−1。这种多功能设计最大限度地利用了太阳能,同时保留了催化活性的表面位点,为综合水处理解决方案的可持续太阳能蒸发器技术迈出了重要的一步。
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引用次数: 0
Temperature-responsive pH buffer T7 enables sustainable one-bath dyeing of nylon 66/cotton blends with improved lightfastness 温度响应pH缓冲液T7使尼龙66/棉混纺织物的一浴染色具有更高的耐光性
IF 4.2 3区 工程技术 Q2 CHEMISTRY, APPLIED Pub Date : 2025-12-13 DOI: 10.1016/j.dyepig.2025.113479
Kangkang Wang, Qiaoyuan Zhen, Tianyu Guo, Xinxin Li, Xiaohong Qin
Conventional two-bath dyeing for nylon 66/cotton blends faces challenges including high resource consumption, limited lightfastness, and unsatisfactory color uniformity. This study develops a sustainable one-bath alternative employing a temperature-responsive pH buffer system, T7 (Tris and Tris-HCl), which enables an autonomous pH transition from alkaline (60 °C) to near-neutral (90 °C) through thermally induced hydrogen bond dissociation. This intelligent pH-switching capability permits sequential fixation of reactive dyes on cotton and neutral dyes on nylon 66 within a single bath. Integrated with stain-resistant pretreatment, optimized dye selection, and nano-ZnO photostabilization, the process demonstrates enhanced lightfastness (Grade 6–7) and improved color uniformity (S value reduced to 0.45). Furthermore, it achieves significant sustainability benefits, with reductions of 31.06 % in energy use, 25.54 % in processing time, 31.33 % in CO2 emissions, and 25.13 % in overall cost compared to conventional two-bath dyeing. The T7-mediated strategy effectively resolves the inherent pH incompatibility in blended fiber dyeing, providing a viable pathway toward eco-friendly textile production.
传统的尼龙66/棉混纺双浴染色存在着资源消耗高、耐光性差、颜色均匀性差等问题。本研究开发了一种可持续的单浴替代方案,采用温度响应pH缓冲系统T7 (Tris和Tris- hcl),通过热诱导氢键离解,实现pH从碱性(60°C)到近中性(90°C)的自主转变。这种智能的ph切换能力允许在单个浴中连续固定活性染料在棉花和中性染料在尼龙66上。结合耐染色预处理、优化染料选择和纳米zno光稳定,该工艺提高了耐光性(6-7级),改善了颜色均匀性(S值降至0.45)。此外,它还具有显著的可持续性效益,与传统的两浴染色相比,能耗减少31.06%,加工时间减少25.54%,二氧化碳排放量减少31.33%,总成本减少25.13%。t7介导策略有效地解决了混纺纤维染色中固有的pH不相容性,为环保纺织品生产提供了一条可行的途径。
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引用次数: 0
Organic room-temperature phosphorescent materials with excellent water stability achieved via methacrylate-vinylidene chloride 通过甲基丙烯酸酯-偏氯乙烯获得具有优异水稳定性的有机室温磷光材料
IF 4.2 3区 工程技术 Q2 CHEMISTRY, APPLIED Pub Date : 2025-12-12 DOI: 10.1016/j.dyepig.2025.113499
Tong Shen , Tian-Yu Liu , Yun-Jie Cai , Yun-Han Wu , Ze-Zhong Lin , Gui-Ying Zhu , Chong Wang , Rong-Chao Xue
Organic room-temperature phosphorescent (RTP) materials are attractive for anti-counterfeiting, information encryption, and bioimaging, but their luminescence is typically rapidly quenched under humid or aqueous conditions. Conventional polymer hosts such as Poly(methyl methacrylate) (PMMA) and Poly(vinyl alcohol) (PVA) lose both fluorescence and phosphorescence within days of exposure to high humidity or water immersion, limiting their practical applications. Here, we present a water-resistant, reversible RTP platform based on methacrylate-vinylidene chloride (MA VDC) composites with organic dyes. Distinct from conventional matrices, MA-VDC forms a dense network stabilised by intrinsic hydrogen bonding and symmetrically arranged chlorine atoms, providing superior oxygen and moisture barrier properties. This structural advantage protects triplet excitons, maintaining stable fluorescence even under prolonged exposure to high humidity or boiling water treatment, and phosphorescence can be fully restored after drying. The demonstrated robustness and reversibility highlight MA VDC as a unique polymer host for next-generation secure optical encryption and anti-counterfeiting technologies.
有机室温磷光(RTP)材料在防伪、信息加密和生物成像方面具有吸引力,但它们的发光通常在潮湿或含水条件下迅速猝灭。传统的聚合物宿主,如聚甲基丙烯酸甲酯(PMMA)和聚乙烯醇(PVA),在暴露于高湿度或浸水的几天内就会失去荧光和磷光,这限制了它们的实际应用。在这里,我们提出了一种基于甲基丙烯酸酯-偏氯乙烯(MA VDC)复合材料和有机染料的防水、可逆RTP平台。与传统的基质不同,MA-VDC形成一个致密的网络,由固有的氢键和对称排列的氯原子稳定,提供优越的氧气和防潮性能。这种结构优势保护了三重态激子,即使在长时间暴露于高湿度或沸水处理下也能保持稳定的荧光,并且在干燥后可以完全恢复磷光。所展示的稳健性和可逆性突出了MA VDC作为下一代安全光学加密和防伪技术的独特聚合物主机。
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引用次数: 0
Templating effect of 2,9-dimethylquinacridone nanocrystals on structural evolution and mechanical properties of polyacrylonitrile-based carbon fibers 2,9-二甲基喹吖酮纳米晶模板化对聚丙烯腈基碳纤维结构演变和力学性能的影响
IF 4.2 3区 工程技术 Q2 CHEMISTRY, APPLIED Pub Date : 2025-12-12 DOI: 10.1016/j.dyepig.2025.113500
Changbeom Jeon , Jung-Eun Lee , Minjung Han , Woong Kwon , Hyejin Ju , Dong-Je Lee , Jihyun Kim , Jong Sung Won , Soo Bin Bae , Euigyung Jeong , Han Gi Chae
This study explores the templating role of organic nanocrystals, specifically 2,9-dimethylquinacridone (PR), in enhancing the mechanical performance of polyacrylonitrile (PAN)-derived carbon fibers. By incorporating PR—structurally analogous to the acridone units formed during PAN stabilization—into the PAN matrix, we investigate how these nanofillers direct the crystalline evolution and reinforce the resulting carbon fibers. PAN/PR nanocomposite fibers were prepared by dry-jet wet spinning, followed by stabilization and carbonization. Microstructural analysis reveals that well-dispersed PR nanocrystals serve as efficient nucleation sites, catalyzing the development of ordered carbon crystalline domains during heat treatment. As a result, carbon fibers containing 1 wt% PR displayed a pronounced increase in tensile strength and modulus (16 % and 13 % higher, respectively, than control samples), attributed to optimal PAN-PR interaction and effective templating effects. These findings demonstrate that the templating behavior of organic crystalline nanofillers can be harnessed to simultaneously promote carbon crystal growth and reinforce mechanical properties in PAN-based carbon fibers. Our results highlight an efficient approach to nanofiller incorporation, establishing 2,9-dimethylquinacridone as a promising, non-polymeric reinforcement for next-generation high-performance carbon fibers.
本研究探讨了有机纳米晶体,特别是2,9-二甲基喹吖酮(PR)在提高聚丙烯腈(PAN)衍生碳纤维力学性能中的模板作用。通过将pr -结构类似于PAN稳定过程中形成的吖啶酮单元-加入PAN基质中,我们研究了这些纳米填料如何指导结晶演变并增强所得到的碳纤维。采用干湿纺丝法制备了PAN/PR纳米复合纤维,并对其进行了稳定化和碳化处理。显微结构分析表明,分散良好的PR纳米晶是有效的成核位点,在热处理过程中催化有序碳晶域的发展。结果,含有1wt % PR的碳纤维显示出明显的抗拉强度和模量增加(分别比对照样品高16%和13%),这归因于最佳的PAN-PR相互作用和有效的模板效果。这些发现表明,有机晶体纳米填料的模板化行为可以同时促进pan基碳纤维的碳晶体生长和增强其力学性能。我们的研究结果强调了纳米填料掺入的有效方法,确立了2,9-二甲基喹吖啶酮作为下一代高性能碳纤维的有前途的非聚合物增强材料。
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引用次数: 0
Modulating novel indosulfoxyl tamarind kernel powder biocomposites: Engineering, structural elucidation, and augmentation of antioxidant efficacy 调节新型吲哚亚砜基罗望子仁粉末生物复合材料:工程、结构解析和增强抗氧化功效
IF 4.2 3区 工程技术 Q2 CHEMISTRY, APPLIED Pub Date : 2025-12-11 DOI: 10.1016/j.dyepig.2025.113495
Sakshi Saini, Jagram Meena
Tamarind kernel powder and its derivatives exhibit significant potential for several applications, ranging from electrochemical appliances to antimicrobial agents. Although promising, modifying tamarind with dye molecules to improve its antioxidant and electrochemical properties has been unexplored. To bridge this gap, we synthesized Indosulfoxyl tamarind kernel powder (ITKP) biocomposites at varying concentrations and evaluated their antioxidant activity using 2,2-Diphenyl-1-Picryl-Hydrazyl-Hydrate (DPPH) and H2O2 free radicals. This investigation has revealed that the antioxidant efficiency of ITKP is dose-dependent and increases with the concentration of the indigotine molecule, reaching up to 83 % and 96 % with IC50 values of 285 μg/ml and 305 μg/ml, respectively, as determined by the DPPH and H2O2 assays. Real-time investigation of the oxidation behaviour of ITKP biocomposites by cyclic voltammetry revealed that ITKP-4 (40 %) demonstrated a superior anodic peak (5.8 μA) compared to ITKP-1 (10 %) (2.8 μA), indicating enhanced electron transfer following radical scavenging, thereby boosting its antioxidant efficiency. The electroactive surface area of the modified glassy carbon electrode with ITKP biocomposites is estimated 0.045 cm2 to be 5 times greater than that of TKP/GCE, indicating the enhanced electrochemical availability of ITKP biocomposites. These findings provide a novel perspective on the antioxidant activity of TKP, aiding in the creation of safer materials and informing regulatory criteria for their biomedical applications.
罗望子仁粉及其衍生物在从电化学器具到抗菌剂等多种应用中表现出巨大的潜力。虽然前景看好,但用染料分子修饰罗望子以改善其抗氧化和电化学性能的研究尚未展开。为了弥补这一空白,我们合成了不同浓度的吲哚亚砜基罗望子仁粉(ITKP)生物复合材料,并利用2,2-二苯基-1- picryl - hydrazyl - hydrate (DPPH)和H2O2自由基评价了它们的抗氧化活性。结果表明,ITKP的抗氧化效率随靛蓝分子浓度的增加而增加,DPPH和H2O2测定的IC50值分别为285 μg/ml和305 μg/ml,达到83%和96%。通过循环伏安法实时检测ITKP生物复合材料的氧化行为,发现ITKP-4(40%)比ITKP-1 (10%) (2.8 μA)表现出更高的阳极峰(5.8 μA),表明自由基清除后电子转移增强,从而提高了其抗氧化效率。ITKP生物复合材料修饰的玻碳电极的电活性表面积估计为0.045 cm2,是TKP/GCE的5倍,表明ITKP生物复合材料的电化学可用性增强。这些发现为TKP的抗氧化活性提供了一个新的视角,有助于创造更安全的材料,并为其生物医学应用的监管标准提供信息。
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引用次数: 0
Y-axis conjugation strategy for dihedral angle modulation enhances the photoacoustic performance of D–A type NIR polymers for high-resolution In vivo imaging y轴共轭二面角调制策略提高了D-A型近红外聚合物高分辨率体内成像的光声性能
IF 4.2 3区 工程技术 Q2 CHEMISTRY, APPLIED Pub Date : 2025-12-11 DOI: 10.1016/j.dyepig.2025.113498
Yongjun Deng , Zhixiong Cao , Rong Luo , Xinru Chen, Zengrong Li, Chu Liu, Qi Liu, Shangqing Xiao, Lin Liu, Xuelong Huang
Semiconductor polymer-based photoacoustic imaging (PAI) holds significant clinical potential due to its non-invasive nature and high resolution, yet is limited by insufficient penetration depth and low signal-to-noise ratio (SNR). To overcome this challenge, enhancing photoacoustic efficiency through molecular engineering of contrast agents is essential. Notably, increasing the donor–acceptor (D–A) dihedral angle has proven effective in promoting non-radiative decay, thereby boosting photoacoustic performance. Here, we report a Y-axis conjugation extension strategy—via lateral functionalization at the bridgehead of the donor to sterically modulate the D–A conformation. With cyclopentadithiophene (CDT) as the donor unit, a vinylene bond was introduced at its bridgehead carbon to develop a planar donor, CDT-V. Subsequently, two NIR polymers—PCDT-V-DPP (with extension) and PCDT-DPP (control)—were synthesized via copolymerization with diketopyrrolopyrrole (DPP). Density functional theory (DFT) calculations reveal a larger D–A dihedral angle in PCDT-V-DPP, which exhibits a 1.82-fold higher SNR than PCDT-DPP in vitro. In vivo, PCDT-V-DPP@NPs enable clear resolution of 20-μm ear and 35-μm brain microvasculature in mice. This work establishes a donor-unit Y-axis conjugation extension approach for optimizing D–A geometry and non-radiative decay, offering a new avenue for high-performance photoacoustic contrast agents.
基于半导体聚合物的光声成像(PAI)因其非侵入性和高分辨率而具有重要的临床潜力,但受穿透深度不足和低信噪比(SNR)的限制。为了克服这一挑战,通过造影剂的分子工程来提高光声效率是必不可少的。值得注意的是,增加供体-受体(D-A)二面角已被证明可有效促进非辐射衰变,从而提高光声性能。在这里,我们报告了一种y轴共轭扩展策略-通过在供体桥头堡的横向功能化来立体调节D-A构象。以环戊二噻吩(CDT)为给体单元,在其桥头堡碳上引入乙烯键,形成平面给体CDT- v。随后,与二酮吡咯(DPP)共聚合成了两种近红外聚合物pcdt - v -DPP(带延伸)和PCDT-DPP(对照)。密度泛函理论(DFT)计算表明,PCDT-V-DPP具有更大的D-A二面角,其信噪比比PCDT-DPP高1.82倍。在小鼠体内,PCDT-V-DPP@NPs能够清晰地分辨20 μm的耳和35 μm的脑微血管。本工作建立了一种用于优化D-A几何形状和非辐射衰减的供体-单位y轴共轭扩展方法,为高性能光声造影剂提供了新的途径。
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引用次数: 0
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Dyes and Pigments
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