Phosphoramidic acid, N,N-bis(2-chloroethyl)-, m-methoxyphenyl phenyl ester
Basic information
- CAS
20464-69-1- Standard SMILES
COc1cccc(OP(=O)(Oc2ccccc2)N(CCCl)CCCl)c1- InChIKey
IIZPXVMHIKFFMM-UHFFFAOYSA-N- Molecular formula
- C17H20Cl2NO4P
- Average molar mass
- 404.2 g/mol
- Monoisotopic mass
- 403.0507005
Names & identifiers
- Preferred name
- Phosphoramidic acid, N,N-bis(2-chloroethyl)-, m-methoxyphenyl phenyl ester
- IUPAC
- 2-chloro-N-(2-chloroethyl)-N-[(3-methoxyphenoxy)-phenoxyphosphoryl]ethanamine
Names & synonyms
20464-69-1Phosphoramidic acid, N,N-bis(2-chloroethyl)-, m-methoxyphenyl phenyl esterRefChem:1095298F 58BRN 2309509N,N-Bis(2-chloroethyl)phosphoramidic acid m-methoxyphenyl phenyl esterDTXSID609426393-Methoxyphenyl phenyl N,N-bis(2-chloroethyl)phosphoramidate
Database identifiers
- CAS
20464-69-1- PubChem CID
- 209799
- DTXSID
DTXSID60942639
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 417
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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