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Basic information
- CAS
400607-94-5- Standard SMILES
CCOP(=O)(CCC(=O)OCc1ccccc1)OCC- InChIKey
UFRWOUSOKWLOST-UHFFFAOYSA-N- Molecular formula
- C14H21O5P
- Average molar mass
- 300.29 g/mol
- Monoisotopic mass
- 300.1126604
Names & identifiers
- Preferred name
- Benzyl 3-(diethoxyphosphoryl)propanoate
- IUPAC
- benzyl 3-diethoxyphosphorylpropanoate
Names & synonyms
Benzyl 3-(diethoxyphosphoryl)propanoate400607-94-5benzyl 3-diethoxyphosphorylpropanoatePropanoic acid, 3-(diethoxyphosphinyl)-, phenylmethyl esterSCHEMBL3047517C14H21O5PDTXSID40785985UFRWOUSOKWLOST-UHFFFAOYSA-Nbenzyl 3-diethylphosphonopropionateMFCD29764401Benzyl3-(diethoxyphosphoryl)propanoate
Database identifiers
- CAS
400607-94-5- PubChem CID
- 71362353
- DTXSID
DTXSID40785985
Properties
Computed structural propertiesFilling in
- XLogP
- 1.5
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 316
Chemistry & industry
Suppliers1 total
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
Related reactions
2 records
Compound notes
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