Basic information
- CAS
31142-29-7- Standard SMILES
CCOP(=O)(OCC)C(N)=O- InChIKey
FRXNIQXHOZNMJM-UHFFFAOYSA-N- Molecular formula
- C5H12NO4P
- Average molar mass
- 181.13 g/mol
- Monoisotopic mass
- 181.05039486
Names & identifiers
- Preferred name
- Diethyl carbamoylphosphonate
- IUPAC
- diethoxyphosphorylformamide
- English name
- Carbamoylphosphonic acid diethyl ester
- Molecular formula
- C5H12NO4P
- Molecular weight
- 181.13
Names & synonyms
diethyl carbamoylphosphonate31142-29-7Carbamoylphosphonic acid diethyl esterdiethoxyphosphorylformamideDIETHYL AMINOCARBONYLPHOSPHONATEdiethyl carbamyl phosphonatediethoxyoxophosphinocarboxamideSCHEMBL10508956FRXNIQXHOZNMJM-UHFFFAOYSA-NBBL002832STK378548AKOS005448388
Show more names
Phosphonic acid, (aminocarbonyl)-, diethyl ester (9CI)
ST50561966
Database identifiers
- CAS
31142-29-7- PubChem CID
- 3692772
- Nikkaji
- J88.707B
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 78.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 171
Related reactions
1 records
Compound notes
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