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2-bromo-1,1-difluoroethane - 97%, high purity , CAS No.359-07-9
Basic Description
Synonyms
2-Bromo-1,1-difluoroethane | 359-07-9 | Ethane, 2-bromo-1,1-difluoro- | 1-BROMO-2,2-DIFLUOROETHANE | 2,2-difluoroethyl bromide | 2,2-difluoro-1-bromoethane | 2-bromo-1,1-difluoro-ethane | 00QR9XS58S | HBFC-142B1 | Ethane,2-bromo-1,1-difluoro- | C2H3BrF2 | UNII-00QR9XS58S | diflu
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
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
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
2-bromo-1,1-difluoroethane
INCHI
InChI=1S/C2H3BrF2/c3-1-2(4)5/h2H,1H2
InChIKey
JVYROUWXXSWCMI-UHFFFAOYSA-N
Smiles
C(C(F)F)Br
Isomeric SMILES
C(C(F)F)Br
Molecular Weight
144.947
Reaxy-Rn
1731771
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731771&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
144.950 g/mol
XLogP3
1.800
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
143.939 Da
Monoisotopic Mass
143.939 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
5
Formal Charge
0
Complexity
21.600
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
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