1,2,3,3,4,4,4-Heptafluoro-1-iodobut-1-ene
Basic information
- CAS
231953-39-2- Standard SMILES
FC(I)=C(F)C(F)(F)C(F)(F)F- InChIKey
QXJDESBAUIILLG-UHFFFAOYSA-N- Molecular formula
- C4F7I
- Average molar mass
- 307.94 g/mol
- Monoisotopic mass
- 307.89329
Names & identifiers
- Preferred name
- 1,2,3,3,4,4,4-Heptafluoro-1-iodobut-1-ene
- IUPAC
- 1,2,3,3,4,4,4-heptafluoro-1-iodobut-1-ene
- English name
- 1-Iodoheptafluorobut-1-ene
- Molecular formula
- C4F7I
- Molecular weight
- 307.94
Names & synonyms
1,2,3,3,4,4,4-heptafluoro-1-iodobut-1-ene113612-30-9231953-39-21-IODOHEPTAFLUOROBUT-1-ENE1-Iodoheptaluorobut-1-enePerfluoro-1-iodo-1-buteneSCHEMBL32659901DTXSID601336808DB-0411791-IODOHEPTAFLUOROBUT-1-ENE, 97% MIN.1,2,3,3,4,4,4-Heptafluoro-1-iodo-1-butene1-Butene, 1,2,3,3,4,4,4-heptafluoro-1-iodo-
Database identifiers
- CAS
231953-39-2- PubChem CID
- 3867752
- DTXSID
DTXSID601336808
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 202
Physicochemical properties
- Boiling point
- 79.6 · 79.6±40.0 °C(Predicted)
- Density
- 2.126 · 2.126±0.06 g/cm3(Predicted)
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- HS Code
- 2903780090 · 2903780090
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
- 2903780090
- risk_code
- 36/37/38
- safety_code
- 26-36/37/39
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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