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2-Bromo-3,4,4,5,5,5-hexafluoro-3-(trifluoromethyl)pent-1-ene

HCID 2736343
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Basic information

CAS
234096-31-2
Standard SMILES
C=C(Br)C(F)(C(F)(F)F)C(F)(F)C(F)(F)F
InChIKey
KCLFCDSPXJFUKO-UHFFFAOYSA-N
Molecular formula
C6H2BrF9
Average molar mass
324.97 g/mol
Monoisotopic mass
323.91962

Names & identifiers

Preferred name
2-Bromo-3,4,4,5,5,5-hexafluoro-3-(trifluoromethyl)pent-1-ene
IUPAC
2-bromo-3,4,4,5,5,5-hexafluoro-3-(trifluoromethyl)pent-1-ene
English name
2-BROMO-3,4,4,5,5,5-HEXAFLUORO-3-(TRIFLUOROMETHYL)PENT-1-ENE
Molecular formula
C6H2BrF9
Molecular weight
324.97

Names & synonyms

2-bromo-3,4,4,5,5,5-hexafluoro-3-(trifluoromethyl)pent-1-ene234096-31-2MFCD001537042-Bromo-3,4,4,5,5,5-hexafluoro-3-(trifluoromethyl)-1-penteneDTXSID90371291KCLFCDSPXJFUKO-UHFFFAOYSA-N2-Bromo-3,4,4,5,5,5-hexafluoro-2-trifluoromethyl-1-penteneAKOS0079300482-Bromo-3,4,4,5,5,5-hexafluoro-3-trifluoromethyl-1-pentene1-Pentene, 2-bromo-3,4,4,5,5,5-hexafluoro-3-(trifluoromethyl)-1H,1H-Nonafluoro(2-bromo-3-methylpent-1-ene)2-Bromo-3,4,4,5,5,5-hexafluoro-3-(trifluoromethyl)pent-1-ene97%
Show more names
2-BROMO-3,4,4,5,5,5-HEXAFLUORO-3-(TRIFLUOROMETHYL)-1-PENTENE, 97% MIN.

Database identifiers

CAS
234096-31-2
PubChem CID
2736343
DTXSID
DTXSID90371291

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
287

Physicochemical properties

form
liquid
color
Clear, colourless
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
280 · P280-P302+P352-P304+P340
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
HazardClass
IRRITANT
HS Code
2903793090 · 2903793090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2903793090
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
hazard_class
IRRITANT
Hazard statements
H315-H319-H335
Precautionary statements
P280-P302+P352-P304+P340

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