3-{[Bis(benzyloxy)phosphoryl]oxy}-2-oxopropyl benzoate
Basic information
- CAS
106787-11-5- Standard SMILES
O=C(COC(=O)c1ccccc1)COP(=O)(OCc1ccccc1)OCc1ccccc1- InChIKey
CIRZBJMQEXLFEK-UHFFFAOYSA-N- Molecular formula
- C24H23O7P
- Average molar mass
- 454.4 g/mol
- Monoisotopic mass
- 454.11814007
Names & identifiers
- Preferred name
- 3-{[Bis(benzyloxy)phosphoryl]oxy}-2-oxopropyl benzoate
- IUPAC
- [3-bis(phenylmethoxy)phosphoryloxy-2-oxopropyl] benzoate
Names & synonyms
106787-11-53-{[Bis(benzyloxy)phosphoryl]oxy}-2-oxopropyl benzoateDTXSID60545629
Database identifiers
- CAS
106787-11-5- PubChem CID
- 13638447
- DTXSID
DTXSID60545629
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 13
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 594
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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