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1-Bromoheptadecafluorooctane - 98%, high purity , CAS No.423-55-2
Basic Description
Synonyms
D05439 | FS-4333 | SR-01000944517-1 | SR-01000944517 | HY-B1724 | Imagent (TN) | PERFLUBRON [USP-RS] | SCHEMBL33826 | V08CX01 | Heptadecafluoro-n-octyl Bromide | PERFLUBRON [ORANGE BOOK] | FT-0607546 | Long's compound | N-perfluorooctyl bromide | bromure
Specifications & Purity
≥98%
Shipped In
Normal
Product Description
1-Bromoheptadecafluorooctane (perfluorooctyl bromide) is a perfluorocarbon. Poly(ethylene glycol)ylated polyester nanocapsules of perfluorooctyl bromide were surface-decorated with a RGD (arginine-glycine-aspartic acid) peptide, were used for tumor imaging. Nanocapsules of perfluorooctyl bromide have been developed as dual contrast agent for ultrasonography and Magnetic Resonance Imaging (MRI).
Oxygen carrier in emulsions used as blood substitutes.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organohalogen compounds
Class
Organofluorides
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Organofluorides
Alternative Parents
Organobromides Hydrocarbon derivatives Alkyl fluorides Alkyl bromides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Hydrocarbon derivative - Organofluoride - Organobromide - Alkyl halide - Alkyl fluoride - Alkyl bromide - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as organofluorides. These are compounds containing a chemical bond between a carbon atom and a fluorine atom.
External Descriptors
fluoroalkane
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.
Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
Pubchem Sid
488181043
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488181043
IUPAC Name
1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane
INCHI
InChI=1S/C8BrF17/c9-7(22,23)5(18,19)3(14,15)1(10,11)2(12,13)4(16,17)6(20,21)8(24,25)26
InChIKey
WTWWXOGTJWMJHI-UHFFFAOYSA-N
Smiles
C(C(C(C(C(F)(F)Br)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F
Isomeric SMILES
C(C(C(C(C(F)(F)Br)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F
WGK Germany
3
RTECS
RG8700000
Molecular Weight
498.96
Beilstein
2016022
Reaxy-Rn
2016022
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2016022&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Not miscible or difficult to mix in water.
Sensitivity
light sensitive
Refractive Index
1.305
Boil Point(°C)
141°C
Melt Point(°C)
6°C
Molecular Weight
498.960 g/mol
XLogP3
6.900
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
17
Rotatable Bond Count
6
Exact Mass
497.891 Da
Monoisotopic Mass
497.891 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
26
Formal Charge
0
Complexity
527.000
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
Citations of This Product
1.
Yupeng Cao, Xiaohan Zhou, Xiaoli Liu, Mei Yang, Wentao Liu, Dong Han.
(2023)
High-Sensitivity, Low-Field 19F-MRI Approach Using High Manganese Ferrite Concentrations.
ANALYTICAL CHEMISTRY,
95
(28):
(10572–10579).
2.
Xu Xiaolin, Guan Wencai, Yu Xiaolei, Xu Guoxiong, Wang Chenglong.
(2023)
Non-interfacial self-assembly of synthetic protocells.
Biomaterials Research,
27
(1):
(1-12).
3.
Liang Hong, Jianman Wang, Yi Zhou, Guofu Shang, Tao Guo, Hailong Tang, Jiangmin Li, Yali Luo, Xiangyu Zeng, Zhu Zeng, Zuquan Hu.
(2023)
Orthogonal Optimization, Characterization, and In Vitro Anticancer Activity Evaluation of a Hydrogen Peroxide-Responsive and Oxygen-Reserving Nanoemulsion for Hypoxic Tumor Photodynamic Therapy.
Cancers,
15
(5):
(1576).
4.
Liyao Zhang, Peijie Huang, Shubin Huang, Tao Wang, Shufeng Chen, Zhihao Chen, Yi Zhou, Linghao Qin.
(2022)
Development of ligand modified erythrocyte coated polydopamine nanomedicine to codeliver chemotherapeutic agent and oxygen for chemo-photothermal synergistic cancer therapy.
INTERNATIONAL JOURNAL OF PHARMACEUTICS,
626
(122156).
5.
Zhang Dong, You Yuanyuan, Xu Yuan, Cheng Qingqing, Xiao Zeyu, Chen Tianfeng, Shi Changzheng, Luo Liangping.
(2022)
Facile synthesis of near-infrared responsive on-demand oxygen releasing nanoplatform for precise MRI-guided theranostics of hypoxia-induced tumor chemoresistance and metastasis in triple negative breast cancer.
JOURNAL OF NANOBIOTECHNOLOGY,
20
(1):
(1-19).
6.
Qin Bing, Jiang Mengshi, Li Xiang, Shi Yingying, Zhang Junlei, Luo Zhenyu, Luo Lihua, Lu Yichao, Liu Xu, Wang Sijie, Du Yongzhong, Qiu Yunqing, Lou Yan, You Jian.
(2021)
Oxygen nanocarrier broke the hypoxia trap of solid tumors and rescued transfection efficiency for gene therapy.
JOURNAL OF NANOBIOTECHNOLOGY,
19
(1):
(1-14).
7.
Xiaoxuan Mai, Yanzhou Chang, Yuanyuan You, Lizhen He, Tianfeng Chen.
(2021)
Designing intelligent nano-bomb with on-demand site-specific drug burst release to synergize with high-intensity focused ultrasound cancer ablation.
JOURNAL OF CONTROLLED RELEASE,
331
(270).
8.
Zheng Wang, Jinsong Ding, Xiaoqian Ma, Shengjuan Luo.
(2018)
Selective ultrasound contrast enhancement in the tumor by nanocapsules with perfluorooctylbromide: effect of PLGA–PEG proportion.
RSC Advances,
8
(32):
(17958-17966).
9.
Shengjuan Luo, Jinsong Ding, Peiqi Wang, Zheng Wang, Xiaoqian Ma, Cejun Yang, Qi Liang, Pengfei Rong, Wei Wang.
(2018)
Carboxyl of Poly(D,L-lactide-co-glycolide) Nanoparticles of Perfluorooctyl Bromide for Ultrasonic Imaging of Tumor.
Contrast Media & Molecular Imaging,
2018
(2957459).
10.
Xichun Qin,Yeqing Zhou,Yuzhuo Wang,Ziyao Wang,Yun Wang,Jiali Chen,Lidong Zhu,Xiaoyu Quan,Zhiwei Liu,Hao Zhang,Liqun Jiang,Hongyan Dong,Zhongming Zhang.
(2020-12-29)
Preparation and Characterization of Protein-loaded PFC Nanoemulsions for the Treatment of Heart Diseases by Pulmonary Administration..
European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences,
158
(105690-105690).
11.
Minghui Sun, Muthu Murugananthan, Zhiming Zhou, Yan Shen, Yanrong Zhang, Xiaoguang Wang.
(2024)
Hydrophobic covalent organic frameworks utilized Fluorocarbon/Water system for efficient hydrogen peroxide photosynthesis.
CHEMICAL ENGINEERING JOURNAL,
486
(150245).
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