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3-bromo-1,1,1-trifluoro-2,2-dimethylpropane - 97%, high purity , CAS No.1447671-73-9

COA

Grade & Purity:

≥97%

Cas Number: 1447671-73-9
Molecular Weight: 205.02
MDL number: MFCD25371537
PubChem CID: 71656147

In stock

Item Number

B629276

Grouped product items
SKU	Size	Availability	Price
B629276-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$294.90
B629276-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$976.90
B629276-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,629.90

Basic Description

Synonyms	1447671-73-9 \| 1-Bromo-2,2-dimethyl-3,3,3-trifluoropropane \| 3-bromo-1,1,1-trifluoro-2,2-dimethylpropane \| SCHEMBL20609225 \| XHC67173 \| MFCD25371537 \| AKOS030211097 \| FS-5956 \| W16553 \| 3-bromo-1,1,1-trifluoro-2,2-dimethyl-propane \| EN300-1930746
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organohalogen compounds
  - Class Organofluorides

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
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

Names and Identifiers

IUPAC Name	3-bromo-1,1,1-trifluoro-2,2-dimethylpropane
INCHI	InChI=1S/C5H8BrF3/c1-4(2,3-6)5(7,8)9/h3H2,1-2H3
InChIKey	OMAWMXSFDUBZGY-UHFFFAOYSA-N
Smiles	CC(C)(CBr)C(F)(F)F
Isomeric SMILES	CC(C)(CBr)C(F)(F)F
PubChem CID	71656147
Molecular Weight	205.02

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	205.020 g/mol
XLogP3	3.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	203.976 Da
Monoisotopic Mass	203.976 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	94.900
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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