1-Cyclooctyl-2,2-difluoroethan-1-one
Basic information
- CAS
127119-02-2- Standard SMILES
O=C(C(F)F)C1CCCCCCC1- InChIKey
SPCPNHXVDGFHOC-UHFFFAOYSA-N- Molecular formula
- C10H16F2O
- Average molar mass
- 190.23 g/mol
- Monoisotopic mass
- 190.11692145
Names & identifiers
- Preferred name
- 1-Cyclooctyl-2,2-difluoroethan-1-one
- IUPAC
- 1-cyclooctyl-2,2-difluoroethanone
- English name
- Ethanone, 1-cyclooctyl-2,2-difluoro- (9CI)
- Molecular formula
- C10H16F2O
- Molecular weight
- 190.2302464
Names & synonyms
127119-02-21-Cyclooctyl-2,2-difluoroethan-1-oneDTXSID00560235RefChem:229772DTXCID305110131-CYCLOOCTYL-2,2-DIFLUOROETHANONEEthanone, 1-cyclooctyl-2,2-difluoro- (9CI)
Database identifiers
- CAS
127119-02-2- PubChem CID
- 14435684
- DTXSID
DTXSID00560235
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 160
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Compound notes
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