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1,2-dibromo-hexafluoro-propane - 99%, high purity , CAS No.661-95-0

COA

Grade & Purity:

≥99%

Cas Number: 661-95-0
Molecular Weight: 309.831
MDL number: MFCD00013568
PubChem CID: 69579

In stock

Item Number

D292576

Grouped product items
SKU	Size	Availability	Price
D292576-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$117.90
D292576-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$206.90
D292576-100g	100g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$646.90

Basic Description

Synonyms	1,2-Dibromohexafluoropropane \| 661-95-0 \| 1,2-Dibromo-1,1,2,3,3,3-hexafluoropropane \| 121163-90-4 \| Propane, 1,2-dibromo-1,1,2,3,3,3-hexafluoro- \| EINECS 211-550-8 \| Hexafluoropropene Dibromide \| BRN 1704033 \| EC 211-550-8 \| SCHEMBL1039199 \| ()-1,2-Dibromohexafluoropropane \| D
Specifications & Purity	≥99%

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	1,2-dibromo-1,1,2,3,3,3-hexafluoropropane
INCHI	InChI=1S/C3Br2F6/c4-1(6,2(5,7)8)3(9,10)11
InChIKey	KTULQNFKNLFOHL-UHFFFAOYSA-N
Smiles	C(C(F)(F)F)(C(F)(F)Br)(F)Br
Isomeric SMILES	C(C(F)(F)F)(C(F)(F)Br)(F)Br
Molecular Weight	309.831
Reaxy-Rn	1704033
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1704033&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Boil Point(°C)	73°
Melt Point(°C)	-95°
Molecular Weight	309.830 g/mol
XLogP3	4.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	1
Exact Mass	309.825 Da
Monoisotopic Mass	307.827 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	152.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
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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