6-Bromohexanoic acid - ≥97% , CAS No.4224-70-8

CAS: 4224-70-8 Cat. No.: B104555 Peso molecular: 195.05 Beilstein Registry Number: 1749740 Número EC: 224-176-5

GRADE & PURITY ≥97%

Synonyms

F3310-0574 | 6bromohexanoic acid | 6-BROMOHEXANOIC ACID | 6-Bromo-hexanoic acid | 6-Bromohexanoic acid, 97% | 6-Bromocaproic acid | 6-bromo-caproic acid | DTXSID5063366 | Hexanoic acid, 6-bromo- | EINECS 224-176-5 | NVRVNSHHLPQGCU-UHFFFAOYSA- | Z104477716

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

F3310-0574 | 6bromohexanoic acid | 6-BROMOHEXANOIC ACID | 6-Bromo-hexanoic acid | 6-Bromohexanoic acid, 97% | 6-Bromocaproic acid | 6-bromo-caproic acid | DTXSID5063366 | Hexanoic acid, 6-bromo- | EINECS 224-176-5 | NVRVNSHHLPQGCU-UHFFFAOYSA- | Z104477716

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: C(CCC(=O)O)CCBr
• IUPAC Name: 6-bromohexanoic acid
• InChIKey: NVRVNSHHLPQGCU-UHFFFAOYSA-N
• INCHI: 1S/C6H11BrO2/c7-5-3-1-2-4-6(8)9/h1-5H2,(H,8,9)
• Isómeros SMILES: C(CCC(=O)O)CCBr
• WGK Alemania: 3
• Número ONU: 3261
• Peso molecular: 195.05
• Beilstein: 1749740
• Reaxy-Rn: 1749740
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1749740&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Clase Fatty Acyls
      • Subclass Fatty acids and conjugates

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Medium-chain fatty acids
• Alternative Parents: Halogenated fatty acids Straight chain fatty acids Monocarboxylic acids and derivatives Carboxylic acids Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Medium-chain fatty acid - Halogenated fatty acid - Straight chain fatty acid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organobromide - Organohalogen compound - Alkyl halide - Organic oxygen compound - Alkyl bromide - Carbonyl group - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.
• External Descriptors: organobromine compound

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Solubilidad: Soluble in methanol.
• Sensibilidad: heat ＆ light sensitive
• Punto de inflamación (°C): 95℃
• Punto de ebullición (°C): 165-170 °C/20 mmHg
• Punto de fusión (°C): 35°C
• Peso molecular: 195.050 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 193.994 Da
• Monoisotopic Mass: 193.994 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 83.100
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referencias

1. Hong Jia, Zihao Chen, Zihan Liu, Shuangye Yang, Yiming Lu, Jie Wei.  (2023)  Photo-induced multi-color fluorescent hydrogels for optical information coding and encryption.  EUROPEAN POLYMER JOURNAL,      [PMID:] [10.1016/j.eurpolymj.2023.112406]

2. Baoxuan Huang, Chen Zhang, Jia Tian, Qiwei Tian, Gang Huang, Weian Zhang.  (2023)  A Cascade BIME-Triggered Near-IR Cyanine Nanoplatform for Enhanced Antibacterial Photodynamic Therapy.  ACS Applied Materials & Interfaces,      [PMID:36794860] [10.1021/acsami.2c22937]

3. Li Cui, Yuheng Fan, Jin Kang, Caixia Yin, Weilu Ding, Hongyan He, Fangqin Cheng.  (2023)  Novel class of crown ether functionalized ionic liquids with multiple binding sites for efficient separation of lithium isotopes.  JOURNAL OF MOLECULAR LIQUIDS,      [PMID:] [10.1016/j.molliq.2023.121412]

4. Futing Yang, Wenjie Yu, Qiying Yu, Xiyu Liu, Chunping Liu, Chong Lu, Xinghua Liao, Yi Liu, Na Peng.  (2023)  Mitochondria-Targeted Nanosystem with Reactive Oxygen Species-Controlled Release of CO to Enhance Photodynamic Therapy of PCN-224 by Sensitizing Ferroptosis.  Small,  19  (16): (2206124).  [PMID:36693788] [10.1002/smll.202206124]

5. Xiayu Liang, Qingle Zeng.  (2022)  Recovery of samarium(III) and cobalt(II) in synthetic nitric acid solutions using carboxyl functionalized ionic liquids and application to recycling SmCo permanent magnets.  HYDROMETALLURGY,      [PMID:] [10.1016/j.hydromet.2022.106016]

6. Huan Xu, Mingyue Yang, Yijing Du, Tian Gao, Yi Liu, Liwei Xiong, Na Peng.  (2022)  Self-assembly of micelles with pH/ROS dual-responsiveness and mitochondrial targeting for potential anti-tumor applications.  NEW JOURNAL OF CHEMISTRY,  46  (44): (21235-21244).  [PMID:] [10.1039/D2NJ03244A]

7. Huimin Jiang, Ruoping Wang, Qian Zhang, Liang Song, Xia Sun, Junpeng Shi, Yun Zhang.  (2022)  A dual-functional nanoplatform based on NIR and green dual-emissive persistent luminescence nanoparticles for X-ray excited persistent luminescence imaging and photodynamic therapy.  Nanoscale,  14  (41): (15451-15461).  [PMID:36226462] [10.1039/D2NR03631B]

8. Xianghan Zhang, Zhiqing Gao, Yuqiong Xia, Qunyan Dong, Yutian Cao, Qian Jia, Fang Sun, Zheng Li, Chu Tang, Jie Yu.  (2022)  Insight into the spatial interaction of D-π-A bridge derived cyanines and nitroreductase for fluorescent cancer hypoxia detection.  SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY,      [PMID:35189489] [10.1016/j.saa.2022.121031]

9. Kaixin Liu, Mingfei Pan, Liping Hong, Xiaoqian Xie, Jingying Yang, Shan Wang, Zhijuan Wang, Shuo Wang.  (2021)  Electrochemical sensing platform for the detection of methyl parathion applying highly biocompatible non-covalent functionalized phosphonium-based ionic liquid@MWCNTs hybrid to immobilize hemoglobin.  BIOSENSORS & BIOELECTRONICS,      [PMID:34740119] [10.1016/j.bios.2021.113755]

10. Yanqin Song, Muhammad Ismail, Qi Shan, Jianing Zhao, Yanping Zhu, Leiming Zhang, Yuan Du, Longbing Ling.  (2021)  ROS-mediated liposomal dexamethasone: a new FA-targeted nanoformulation to combat rheumatoid arthritis via inhibiting iRhom2/TNF-α/BAFF pathways.  Nanoscale,  13  (47): (20170-20185).  [PMID:34846489] [10.1039/D1NR05518F]

11. Tianlin Wang, Yue Zheng, Guangren Yu, Xiaochun Chen.  (2021)  Glycolysis of polyethylene terephthalate: Magnetic nanoparticle CoFe2O4 catalyst modified using ionic liquid as surfactant.  EUROPEAN POLYMER JOURNAL,      [PMID:] [10.1016/j.eurpolymj.2021.110590]

12. Qiang Hu, Kesi Wang, Liyan Qiu.  (2020)  6-Aminocaproic acid as a linker to improve near-infrared fluorescence imaging and photothermal cancer therapy of PEGylated indocyanine green.  COLLOIDS AND SURFACES B-BIOINTERFACES,      [PMID:33017715] [10.1016/j.colsurfb.2020.111372]

13. Songsong Tang, Chuanxiang Qin, Guoqiang Chen, Zhimin Bao, Xueni Hou.  (2018)  Synthesis and Dyeing Properties of Three Hemicyanine-Based Fluorescent Polymeric Dyes.  AATCC Journal of Research,      [PMID:] [10.14504/ajr.5.2.2]

14. Xiangyu Li, Yuwei Ye, Tong Liu, Wenru Zheng, Feng Yang, Haichao Zhao, Liping Wang.  (2017)  Corrosion inhibition of Q235 steel in 1 M HCl using quaternized tetraaniline as a corrosion inhibitor.  Surface Topography-Metrology and Properties,  5  (4): (044001).  [PMID:] [10.1088/2051-672X/aa8c0e]

15. Yuehua Chen, Huiyong Wang, Yuanchao Pei, Jianji Wang.  (2017)  Selective separation of scandium (III) from rare earth metals by carboxyl-functionalized ionic liquids.  SEPARATION AND PURIFICATION TECHNOLOGY,      [PMID:] [10.1016/j.seppur.2017.01.058]

16. Liyi Fu, Pan Yuan, Zheng Ruan, Le Liu, Tuanwei Li, Lifeng Yan.  (2016)  Ultra-pH-sensitive polypeptide micelles with large fluorescence off/on ratio in near infrared range.  Polymer Chemistry,  8  (6): (1028-1038).  [PMID:] [10.1039/C6PY01818A]

17. Yuehua Chen, Huiyong Wang, Yuanchao Pei, Jiao Ren, Jianji Wang.  (2015)  pH-Controlled Selective Separation of Neodymium (III) and Samarium (III) from Transition Metals with Carboxyl-Functionalized Ionic Liquids.  ACS Sustainable Chemistry & Engineering,      [PMID:] [10.1021/acssuschemeng.5b00742]

18. Yanfang Wang, Beibei Wang, Han Liao, Xiaojie Song, Hao Wu, Huihui Wang, Hujun Shen, Xiaojun Ma, Mingqian Tan.  (2015)  Liposomal nanohybrid cerasomes for mitochondria-targeted drug delivery.  Journal of Materials Chemistry B,  3  (36): (7291-7299).  [PMID:32262837] [10.1039/C5TB01197C]

19. Zian Lin, Ruifang Yu, Wenli Hu, Jiangnan Zheng, Ping Tong, Hongzhi Zhao, Zongwei Cai.  (2015)  Preparation of a poly(3′-azido-3′-deoxythymidine-co-propargyl methacrylate-co-pentaerythritol triacrylate) monolithic column by in situ polymerization and a click reaction for capillary liquid chromatography of small molecules and proteins.  ANALYST,  140  (13): (4626-4635).  [PMID:25962738] [10.1039/C5AN00409H]

20. Xiangyu Liu, Jingwen He, Yile Niu, Yefei Li, Ding Hu, Xinnian Xia, Yanbing Lu, Weijian Xu.  (2015)  Photo-responsive amphiphilic poly(α-hydroxy acids) with pendent o-nitrobenzyl ester constructed via copper-catalyzed azide-alkyne cycloaddition reaction.  POLYMERS FOR ADVANCED TECHNOLOGIES,  26  (5): (449-456).  [PMID:] [10.1002/pat.3472]

21. Qingqing Zhang, Rui Cao, Hao Fei, Ming Zhou.  (2014)  Mitochondria-targeting phosphorescent iridium(III) complexes for living cell imaging.  DALTON TRANSACTIONS,  43  (44): (16872-16879).  [PMID:25287363] [10.1039/C4DT00823E]

22. Li Cui, Ren Gao, Qiaowei Zhang, Kun Jiang, Hongyan He, Wei-Lu Ding, Fangqin Cheng.  (2024)  Benzo-15-Crown-5 Functionalized Ionic Liquids with Enhanced Stability for Effective Separation of Lithium Isotopes: The Effect of Alkyl Chain Length.  ACS Sustainable Chemistry & Engineering,      [PMID:] [10.1021/acssuschemeng.3c05171]

23. Lin Liu, Kaiyan Huang, Xianggui Yin, Jinyuan Wang, Yan Gao, Junpeng Shi, Fangrong Zhang, Xia Sun, Chaohui Zheng.  (2024)  Biological window excited up-conversion persistent luminescence nanoparticles for bioimaging and photodynamic therapy.  Journal of Saudi Chemical Society,      [PMID:] [10.1016/j.jscs.2024.101893]

24. Qianqian Qi, Zhanyu Zhang, Dun Wang.  (2025)  GSH-responsive paclitaxel prodrug used in chemotherapy in combination with photodynamic therapy.  BIOORGANIC CHEMISTRY,      [PMID:40007348] [10.1016/j.bioorg.2025.108289]

25. Xiayu Liang, Aylin M. Deliormanlı, Qingle Zeng.  (2024)  Poly(ionic liquids-acrylic acid)-modified MIL-101(Cr) metal−organic frameworks: Preparation and efficient adsorption of europium☆.  JOURNAL OF RARE EARTHS,      [PMID:] [10.1016/j.jre.2024.09.017]

26. Shaohua Liu, Chen Wang, Chaoran Wang, Yuanyuan Deng, Yanping Tang, Boshi Tian, Hongjun Xia, Yahong Chen, Lin Jin, Zhengxiao Guo, Piaoping Yang.  (2025)  A biodegradable self-cascading copper-based nanozyme for augmented cancer catalytic therapy and cuproptosis.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:40829233] [10.1016/j.jcis.2025.138692]

27. Xueyang Xu, Hongli Zhang, Qingyuan Jiang, Qingyun Li, Zhu Tao, Dingwu Pan, Xin Xiao.  (2025)  Construction of a new supramolecular probe with turn-on mechanism for tricyclazole detection.  MICROCHEMICAL JOURNAL,      [PMID:] [10.1016/j.microc.2025.114730]

28. Bing-Feng Zhang, Lei Xing, Peng-Fei Cui, Feng-Zhen Wang, Rong-Lin Xie, Jia-Liang Zhang, Mei Zhang, Yu-Jing He, Jin-Yuan Lyu, Jian-Bin Qiao, Bao-An Chen, Hu-Lin Jiang.  (2015)  Mitochondria apoptosis pathway synergistically activated by hierarchical targeted nanoparticles co-delivering siRNA and lonidamine.  BIOMATERIALS,      [PMID:26004233] [10.1016/j.biomaterials.2015.05.027]

29. Yugang Song, Song Feng, Rongli Li, Lihua Zhang, Haibo Xie.  (2025)  Harnessing photo-responsive azobenzene-functionalized chitosan nanomicelles for UV protection of photosensitive pesticides.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,      [PMID:40222503] [10.1016/j.ijbiomac.2025.143017]

30. Kexin Liang, Weisheng Feng, Yiyang Liu, Jianqi Zhang, Feng Tian, Yuan Yao, Xuesong Jiang, Shaoliang Lin.  (2025)  “All-in-One Functionalization and Synergic Ordering” Strategy Enables Multimode Anti-Counterfeiting Patterns.  ACS Applied Materials & Interfaces,      [PMID:40131739] [10.1021/acsami.5c02062]

31. Yaqi Wang, Ping Shu, Mei Lv, Yonghao Xing, Haoran Zhang, Xiaojing Yan, Bo Wang, Tingting Huang, Minfeng Fang.  (2025)  A general strategy to screen and evaluate antitussive, anti-inflammatory, and expectorant active components from raw and honey-fired Farfarae Flos based on β2-AR/CysLT1R/M3R chromatography and mice models.  JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS,      [PMID:41494282] [10.1016/j.jpba.2025.117331]

32. Wenjun Chen, Rui Zhang, Xiaobo Hu, Jingsheng Ma, Duna Su, Chuanli Wu, Yanqiao Xu, Xiuxun Han.  (2025)  Synergistic Surface Modification of Bromocarboxylic Acid-Oleylamine Dual Ligands for Highly Stable and Luminescent CsPbBr3 Perovskite Nanocrystals.  MOLECULES,  31  (1): (127).  [PMID:41515421] [10.3390/molecules31010127]