Basic information
- CAS
62050-98-0- Standard SMILES
O=C(CCC(O)c1ccccc1)NCc1ccccc1- InChIKey
ULHAVBIDOJFVKR-UHFFFAOYSA-N- Molecular formula
- C17H19NO2
- Average molar mass
- 269.34 g/mol
- Monoisotopic mass
- 269.14157885
Names & identifiers
- Preferred name
- n-Benzyl-4-hydroxy-4-phenylbutanamide
- IUPAC
- N-benzyl-4-hydroxy-4-phenylbutanamide
Names & synonyms
62050-98-0n-benzyl-4-hydroxy-4-phenylbutanamideNSC150173SCHEMBL7166881DTXSID00302314ULHAVBIDOJFVKR-UHFFFAOYSA-NNSC-150173N-benzyl-4-hydroxy-4-phenyl-butyramide
Database identifiers
- CAS
62050-98-0- PubChem CID
- 288829
- DTXSID
DTXSID00302314- Nikkaji
- J1.088.808E
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 281
Related reactions
3 records
Compound notes
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