Basic information
- CAS
333-06-2- Standard SMILES
O=C(CF)CCCCCF- InChIKey
ONBDJQNIAOQQGT-UHFFFAOYSA-N- Molecular formula
- C7H12F2O
- Average molar mass
- 150.17 g/mol
- Monoisotopic mass
- 150.08562133
Names & identifiers
- Preferred name
- 2-Heptanone, 1,7-difluoro-
- IUPAC
- 1,7-difluoroheptan-2-one
- English name
- 2-Heptanone, 1,7-difluoro-
- Molecular formula
- C7H12F2O
- Molecular weight
- 0
Names & synonyms
1,7-Difluoro-2-heptanone333-06-22-HEPTANONE, 1,7-DIFLUORO-BRN 1751959DTXSID001869194-01-00-03320 (Beilstein Handbook Reference)RefChem:261370DTXCID901094101,7-difluoroheptan-2-one
Database identifiers
- CAS
333-06-2- PubChem CID
- 9519
- DTXSID
DTXSID00186919- Nikkaji
- J49.365A
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 93.6
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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