Phosphoramidic acid, 2,5-xylyl-, diethyl ester (8CI)
Basic information
- CAS
22846-97-5- Standard SMILES
CCOP(=O)(Nc1cc(C)ccc1C)OCC- InChIKey
ODAYIJXUKBMRIZ-UHFFFAOYSA-N- Molecular formula
- C12H20NO3P
- Average molar mass
- 257.27 g/mol
- Monoisotopic mass
- 257.1180805
Names & identifiers
- Preferred name
- Phosphoramidic acid, 2,5-xylyl-, diethyl ester (8CI)
- IUPAC
- N-diethoxyphosphoryl-2,5-dimethylaniline
Names & synonyms
22846-97-5NSC263537Phosphoramidic acid, 2,5-xylyl-, diethyl ester (8CI)DTXSID40312831NSC-263537Diethyl N-(2,5-dimethylphenyl)phosphoramidate
Database identifiers
- CAS
22846-97-5- PubChem CID
- 319397
- DTXSID
DTXSID40312831- Nikkaji
- J2.772.418C
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 262
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Compound notes
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