Basic information
- CAS
161117-17-5- Standard SMILES
O=C(F)[C@@H]1CCC[C@H](C(=O)F)C1- InChIKey
KQFJQLFSKYQMPZ-OLQVQODUSA-N- Molecular formula
- C8H10F2O2
- Average molar mass
- 176.16 g/mol
Names & identifiers
- Preferred name
- cis-(1R,3S)-cyclohexane-1,3-dicarbonyl fluoride
- IUPAC
- cis-(1R,3S)-cyclohexane-1,3-dicarbonyl fluoride
- English name
- 1,3-Cyclohexanedicarbonyl difluoride, cis- (9CI)
- Molecular formula
- C8H10F2O2
- Molecular weight
- 176.16
Names & synonyms
1,3-Cyclohexanedicarbonyl difluoride, cis- (9CI)
Database identifiers
- CAS
161117-17-5
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Boiling point
- 239.8 · 239.8±20.0 °C(Predicted)
- Density
- 1.199 · 1.199±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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