Basic information
- CAS
426-66-4- Standard SMILES
CCCCC(=O)C(F)(F)C(F)(F)F- InChIKey
YKFGODOXZOKYPZ-UHFFFAOYSA-N- Molecular formula
- C7H9F5O
- Average molar mass
- 204.14 g/mol
- Monoisotopic mass
- 204.05735572
Names & identifiers
- Preferred name
- 1,1,1,2,2-Pentafluoroheptan-3-one
- IUPAC
- 1,1,1,2,2-pentafluoroheptan-3-one
Names & synonyms
1,1,1,2,2-pentafluoroheptan-3-one426-66-4NSC42748DTXSID50285764YKFGODOXZOKYPZ-UHFFFAOYSA-NNSC-42748DS-008136
Database identifiers
- CAS
426-66-4- PubChem CID
- 238409
- DTXSID
DTXSID50285764
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 184
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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