Basic information
- Standard SMILES
COC(=O)C(OC)C(O)c1ccc(OCc2ccccc2)c(OC)c1- InChIKey
OPJUTSGIUHUKTA-UHFFFAOYSA-N- Molecular formula
- C19H22O6
- Average molar mass
- 346.4 g/mol
- Monoisotopic mass
- 346.14163842
Names & identifiers
- Preferred name
- 3-(4-Benzyloxy-3-methoxy-phenyl)-3-hydroxy-2-methoxy-propionic acid methyl ester
- IUPAC
- methyl 3-hydroxy-2-methoxy-3-(3-methoxy-4-phenylmethoxyphenyl)propanoate
Names & synonyms
SCHEMBL5377231OPJUTSGIUHUKTA-UHFFFAOYSA-N3-(4-benzyloxy-3-methoxy-phenyl)-3-hydroxy-2-methoxy-propionic acid methyl ester
Database identifiers
- PubChem CID
- 58822925
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 395
Related reactions
3 records
Linked notes
Loading…