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1,1,1,2,4,4,4-Heptafluorobut-2-ene

HCID 498797
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Basic information

CAS
760-42-9
Standard SMILES
FC(=CC(F)(F)F)C(F)(F)F
InChIKey
YIFLMZOLKQBEBO-UHFFFAOYSA-N
Molecular formula
C4HF7
Average molar mass
182.04 g/mol
Monoisotopic mass
181.99664717

Names & identifiers

Preferred name
1,1,1,2,4,4,4-Heptafluorobut-2-ene
IUPAC
1,1,1,2,4,4,4-heptafluorobut-2-ene
English name
1,1,1,2,4,4,4-Heptafluoro-2-butene
Molecular formula
C4HF7
Molecular weight
182.04

Names & synonyms

1,1,1,2,4,4,4-heptafluorobut-2-eneSCHEMBL332783DTXSID50997355YIFLMZOLKQBEBO-UHFFFAOYSA-N2-Butene, 1,1,1,2,4,4,4-heptafluoro-2H-heptafluorobut-2-ene3H-Heptafluorobut-2-ene97%3H-Heptafluorobut-2-ene 97%2H-Heptafluorobut-2-ene 97%1,1,1,2,4,4,4-Heptafluoro-2-butene1,1,1,2,4,4,4-Heptafluorobut-2-ene97%1,1,1,2,4,4,4-Heptafluorobut-2-ene 97%

Database identifiers

CAS
760-42-9
PubChem CID
498797
DTXSID
DTXSID50997355

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
0
Heavy atoms
11
Formal charge
0
Complexity
158

Physicochemical properties

Boiling point
8 °C · 8°C
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
280 · H280-H315-H319
Precautionary statements
264 · P264-P302+P352-P305+P351+P338
Hazard Codes
Xi
Safety Statements
23 · 23-38
RIDADR
3163 · 3163
Hazard Note
Irritant
HazardClass
GAS
HS Code
2903590090 · 2903590090

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

ridadr
3163
hs_code
2903590090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
hazard_note
Irritant
safety_code
23-38
hazard_class
GAS
Hazard statements
H280-H315-H319
Precautionary statements
P264-P302+P352-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Downstream products

2-Chloro-1,1,1,4,4,4-hexafluoro-2-buteneOctafluoro-1-butene

Related reactions

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Compound notes

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