Basic information
- Standard SMILES
CCOP(=O)(CNc1ccc(Cl)cc1N)OCC- InChIKey
PNZDVMGMHFOHOJ-UHFFFAOYSA-N- Molecular formula
- C11H18ClN2O3P
- Average molar mass
- 292.7 g/mol
- Monoisotopic mass
- 292.0743571
Names & identifiers
- Preferred name
- Diethyl (2-amino-4-chloroanilino)methylphosphonate
- IUPAC
- 4-chloro-1-N-(diethoxyphosphorylmethyl)benzene-1,2-diamine
Names & synonyms
SCHEMBL7920415Diethyl (2-amino-4-chloroanilino)methylphosphonate[(2-Amino-4-chloro-phenylamino)-methyl]-phosphonic acid diethyl ester
Database identifiers
- PubChem CID
- 592810
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 73.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 283
Related reactions
2 records
Compound notes
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