2-Chloropentafluoro-1,3-butadiene
Basic information
- CAS
392-42-7- Standard SMILES
FC(F)=C(F)C(Cl)=C(F)F- InChIKey
ZQZMAJGEFXFVCR-UHFFFAOYSA-N- Molecular formula
- C4ClF5
- Average molar mass
- 178.49 g/mol
- Monoisotopic mass
- 177.9608685
Names & identifiers
- Preferred name
- 2-Chloropentafluoro-1,3-butadiene
- IUPAC
- 2-chloro-1,1,3,4,4-pentafluorobuta-1,3-diene
- English name
- 2-CHLOROPENTAFLUORO-1,3-BUTADIENE
- Molecular formula
- C4ClF5
- Molecular weight
- 178.49
Names & synonyms
2-Chloropentafluoro-1,3-butadiene392-42-7DTXSID90371493RefChem:259534DTXCID503225272-chloro-1,1,3,4,4-pentafluorobuta-1,3-dieneSCHEMBL4409251ZQZMAJGEFXFVCR-UHFFFAOYSA-NSBB089471AKOS006228994DB-0493953-chloro-1,1,2,4,4-pentafluorobuta-1,3-diene
Show more names
2-CHLOROPENTAFLUOROBUTADIENE2-Chloropentafluoro-1,3-butadiene97%2-Chloropentafluoro-1,3-butadiene 97%1,3-Butadiene, 2-chloro-1,1,3,4,4-pentafluoro-
Database identifiers
- CAS
392-42-7- PubChem CID
- 2736632
- DTXSID
DTXSID90371493
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Boiling point
- 37 °C · 37 °C
- Density
- 1.492 · 1.492±0.06 g/cm3(Predicted)
- refractive index
- 1.3385 · 1.3385
- CAS DataBase Reference
- 392 · 392-42-7(CAS DataBase Reference)
- Hazard Codes
- F,T
- Risk Statements
- 10 · 10-23/24/25
- Safety Statements
- 16 · 16-23-36/37-45
- RIDADR
- 1993 · 1993
- Hazard Note
- Flammable/Toxic
- HS Code
- 2903779090 · 2903779090
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
- 1993
- hs_code
- 2903779090
- risk_code
- 10-23/24/25
- hazard_code
- F,T
- hazard_note
- Flammable/Toxic
- safety_code
- 16-23-36/37-45
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Compound notes
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