Basic information
- CAS
53235-77-1- Standard SMILES
CCOC(=O)C(=Cc1ccccc1)P(=O)(OCC)OCC- InChIKey
AFGMDHDZHUKXMX-UHFFFAOYSA-N- Molecular formula
- C15H21O5P
- Average molar mass
- 312.3 g/mol
- Monoisotopic mass
- 312.11266076
Names & identifiers
- Preferred name
- 2-Propenoic acid, 2-(diethoxyphosphinyl)-3-phenyl-, ethyl ester, (2E)-
- IUPAC
- ethyl 2-diethoxyphosphoryl-3-phenylprop-2-enoate
Names & synonyms
53235-77-12-Propenoic acid, 2-(diethoxyphosphinyl)-3-phenyl-, ethyl ester, (2E)-DTXSID10345252ethyl 2-(diethoxyphosphoryl)-3-phenylprop-2-enoate
Database identifiers
- CAS
53235-77-1- PubChem CID
- 602986
- DTXSID
DTXSID10345252
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 389
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…