Pentafluoropropionic acid, tridecyl ester
Basic information
- CAS
959261-22-4- Standard SMILES
CCCCCCCCCCCCCOC(=O)C(F)(F)C(F)(F)F- InChIKey
WGTROCTZHUYVJI-UHFFFAOYSA-N- Molecular formula
- C16H27F5O2
- Average molar mass
- 346.38 g/mol
- Monoisotopic mass
- 346.19312091
Names & identifiers
- Preferred name
- Pentafluoropropionic acid, tridecyl ester
- IUPAC
- tridecyl 2,2,3,3,3-pentafluoropropanoate
Names & synonyms
Pentafluoropropionic acid, tridecyl esterDTXSID501353722Pentafluoropropionic acid tridecyl ester959261-22-4
Database identifiers
- CAS
959261-22-4- PubChem CID
- 537281
- DTXSID
DTXSID501353722
Properties
Computed structural properties
- XLogP
- 7.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 14
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 316
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…