Basic information
- Standard SMILES
CCCC[C@H](O[C@H](Cc1ccccc1)C(=O)OC(c1ccccc1)c1ccccc1)c1ccco1- InChIKey
ZAFFMIRXWPCQQY-URLMMPGGSA-N- Molecular formula
- C31H32O4
- Average molar mass
- 468.6 g/mol
Names & identifiers
- Preferred name
- (2R,4S) benzhydryl 2-Benzyl-4-(2-furyl)-3-oxaoctanoate
- IUPAC
- benzhydryl (2R)-2-[(1S)-1-(furan-2-yl)pentoxy]-3-phenylpropanoate
Names & synonyms
SCHEMBL7351454ZAFFMIRXWPCQQY-URLMMPGGSA-N(2R,4S) benzhydryl 2-Benzyl-4-(2-furyl)-3-oxaoctanoate
Database identifiers
- PubChem CID
- 70062813
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 48.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 571
Related reactions
2 records
Compound notes
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