Basic information
- CAS
39118-07-5- Standard SMILES
CCCOC(=O)C(F)(F)C(F)(F)F- InChIKey
NZZLJQBPSUUZOQ-UHFFFAOYSA-N- Molecular formula
- C6H7F5O2
- Average molar mass
- 206.11 g/mol
- Monoisotopic mass
- 206.03662027
Names & identifiers
- Preferred name
- Propyl pentafluoropropanoate
- IUPAC
- propyl 2,2,3,3,3-pentafluoropropanoate
Names & synonyms
Propyl pentafluoropropanoate39118-07-5Propanoic acid, pentafluoro-, propyl estern-propyl pentafluoropropionate2,2,3,3,3-Pentafluoro-propionic acid propyl esterSCHEMBL2691400DTXSID90335696Pentafluoropropionic acid, propyl ester
Database identifiers
- CAS
39118-07-5- PubChem CID
- 526451
- DTXSID
DTXSID90335696
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 186
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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