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2,3,4,5,6-Pentafluorobenzyl bromide - for GC derivatization，99%, high purity , CAS No.1765-40-8
Basic Description
Synonyms
1765-40-8 | 2,3,4,5,6-Pentafluorobenzyl bromide | Pentafluorobenzyl bromide | 1-(Bromomethyl)-2,3,4,5,6-pentafluorobenzene | alpha-Bromo-2,3,4,5,6-pentafluorotoluene | (Bromomethyl)pentafluorobenzene | 1-Bromomethylpentafluorobenzene | BENZENE, (BROMOMETHYL)PENTAFLUORO
Specifications & Purity
for GC derivatization, ≥99%
Storage Temp
Store at 2-8°C,Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Grade
for GC derivatization
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzyl halides
Intermediate Tree Nodes
Not available
Direct Parent
Benzyl bromides
Alternative Parents
Fluorobenzenes Aryl fluorides Organofluorides Organobromides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzyl bromide - Halobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Hydrocarbon derivative - Organofluoride - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzyl bromides. These are organic compounds containing a benzene skeleton substituted with a bromomethyl group.
External Descriptors
Not available
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.
Names and Identifiers
IUPAC Name
1-(bromomethyl)-2,3,4,5,6-pentafluorobenzene
INCHI
InChI=1S/C7H2BrF5/c8-1-2-3(9)5(11)7(13)6(12)4(2)10/h1H2
InChIKey
XDEPVFFKOVDUNO-UHFFFAOYSA-N
Smiles
C(C1=C(C(=C(C(=C1F)F)F)F)F)Br
Isomeric SMILES
C(C1=C(C(=C(C(=C1F)F)F)F)F)Br
WGK Germany
3
UN Number
3265
Packing Group
II
Molecular Weight
260.99
Beilstein
647808
Reaxy-Rn
647808
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=647808&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Hydrolyzes in water.
Sensitivity
Moisture sensitive
Freezing Point(°C)
18 °C
Refractive Index
1.471
Flash Point(°F)
181.4℉
Flash Point(°C)
83℃
Boil Point(°C)
174-175°C
Melt Point(°C)
19-20°C
Molecular Weight
260.990 g/mol
XLogP3
3.000
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
1
Exact Mass
259.926 Da
Monoisotopic Mass
259.926 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
162.000
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.
Zhichun Zhang, Mingkai Xu, Lei Wang, Wu Gu, Xiang Li, Zhiyang Han, Xuanhe Fu, Xiujuan Wang, Xu Li, Zhencheng Su.
(2023)
Continuous oral exposure to micro- and nanoplastics induced gut microbiota dysbiosis, intestinal barrier and immune dysfunction in adult mice. ENVIRONMENT INTERNATIONAL,
182
(108353).
2.
Wu Gu, Huiwen Zhang, Zhichun Zhang, Mingkai Xu, Xiang Li, Zhiyang Han, Xuanhe Fu, Xu Li, Xiujuan Wang, Chenggang Zhang.
(2024)
Continuous Oral Administration of the Superantigen Staphylococcal Enterotoxin C2 Activates Intestinal Immunity and Modulates the Gut Microbiota in Mice. Advanced Science,
(2405039).
3.
Zhang Wanjun, Tang Yutong, Fan Ruiqi, Zhang Fude, Li Yongchen, Zang Jianjun, Yang Wenjun, Wang Zongyi, Yuan Xiaoyan, Yang Yuan, Chen Yiqiang.
(2024)
Effects of the pesticide carbendazim on broiler chicken health and carbendazim residue levels in broiler tissues. VETERINARY RESEARCH COMMUNICATIONS,
(1-8).
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3 Citations
B2527329