Basic information
- Standard SMILES
COc1cc(P(=O)(OCc2ccccc2)OCc2ccccc2)cc(OC)c1OC- InChIKey
ZGNCTNIWEFOYOI-UHFFFAOYSA-N- Molecular formula
- C23H25O6P
- Average molar mass
- 428.4 g/mol
Names & identifiers
- Preferred name
- Dibenzyl 3,4,5-trimethoxyphenylphosphonate
- IUPAC
- 5-bis(phenylmethoxy)phosphoryl-1,2,3-trimethoxybenzene
Names & synonyms
SCHEMBL6517613ZGNCTNIWEFOYOI-UHFFFAOYSA-NDibenzyl 3,4,5-trimethoxyphenylphosphonate
Database identifiers
- PubChem CID
- 54545930
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 63.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 492
Related reactions
6 records
Compound notes
Loading…