Basic information
- CAS
422-51-5- Standard SMILES
FC(F)C(F)(F)C(Cl)(Cl)Cl- InChIKey
LJPLFJPOUHWADA-UHFFFAOYSA-N- Molecular formula
- C3HCl3F4
- Average molar mass
- 219.39 g/mol
- Monoisotopic mass
- 217.907996
Names & identifiers
- Preferred name
- 1,1,1-Trichloro-2,2,3,3-tetrafluoropropane
- IUPAC
- 1,1,1-trichloro-2,2,3,3-tetrafluoropropane
- English name
- 1,1,1-Trichloro-2,2,3,3-tetrafluoropropane
- Molecular formula
- C3HCl3F4
- Molecular weight
- 219.39
Names & synonyms
1,1,1-Trichloro-2,2,3,3-tetrafluoropropane422-51-5BRN 20732602,2,3,3-Tetrafluoro-1,1,1-trichloropropanePropane, 2,2,3,3-tetrafluoro-1,1,1-trichloro-RefChem:212936Propane, 1,1,1-trichloro-2,2,3,3-tetrafluoro-SCHEMBL251006SCHEMBL2809989DTXSID9075244LJPLFJPOUHWADA-UHFFFAOYSA-N
Database identifiers
- CAS
422-51-5- PubChem CID
- 67908
- DTXSID
DTXSID9075244- Nikkaji
- J50.926D
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 117
Physicochemical properties
- Boiling point
- 94.69 °C · 94.69°C (rough estimate)
- Density
- 1.5217 · 1.5217 (estimate)
- refractive index
- 1.3668 · 1.3668 (estimate)
- EPA Substance Registry System
- 1 · Propane, 1,1,1-trichloro-2,2,3,3-tetrafluoro- (422-51-5)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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