Propanoic acid, pentafluoro-, 2-[2-[(2,2,3,3,3-pentafluoro-1-oxopropyl)amino]ethyl]phenyl ester
Basic information
- CAS
77774-26-6- Standard SMILES
O=C(NCCc1ccccc1OC(=O)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F- InChIKey
DECFLQYBQRQVDA-UHFFFAOYSA-N- Molecular formula
- C14H9F10NO3
- Average molar mass
- 429.21 g/mol
- Monoisotopic mass
- 429.04227477
Names & identifiers
- Preferred name
- Propanoic acid, pentafluoro-, 2-[2-[(2,2,3,3,3-pentafluoro-1-oxopropyl)amino]ethyl]phenyl ester
- IUPAC
- [2-[2-(2,2,3,3,3-pentafluoropropanoylamino)ethyl]phenyl] 2,2,3,3,3-pentafluoropropanoate
Names & synonyms
Propanoic acid, pentafluoro-, 2-[2-[(2,2,3,3,3-pentafluoro-1-oxopropyl)amino]ethyl]phenyl esterDECFLQYBQRQVDA-UHFFFAOYSA-NDTXSID3010452122-Hydroxy-2-phenylethylamine, di-PFP77774-26-6[2-[2-(Perfluoropropanoyl)aminoethyl]phenyl] perfluoropropanoate2-(2-[(2,2,3,3,3-Pentafluoropropanoyl)amino]ethyl)phenyl 2,2,3,3,3-pentafluoropropanoate #
Database identifiers
- CAS
77774-26-6- PubChem CID
- 620152
- DTXSID
DTXSID301045212- Nikkaji
- J530.098C
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 573
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Compound notes
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