Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester
Basic information
- CAS
78218-72-1- Standard SMILES
O=P(OCCCl)(Oc1ccccc1)N(CCCl)CCCl- InChIKey
CCJANWHEDDRRBP-UHFFFAOYSA-N- Molecular formula
- C12H17Cl3NO3P
- Average molar mass
- 360.6 g/mol
- Monoisotopic mass
- 359.001163
Names & identifiers
- Preferred name
- Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester
- IUPAC
- 2-chloro-N-[2-chloroethoxy(phenoxy)phosphoryl]-N-(2-chloroethyl)ethanamine
Names & synonyms
78218-72-1Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl esterRefChem:10952992-Chloroethyl phenyl N,N-bis(2-chloroethyl)phosphoramidateB 803NSC 59222BRN 2542425Phosphoramidic acid, bis(2-chloroethyl)-, 2-chloroethyl phenyl esterDTXSID901384844NSC59222NSC-59222Phosphoramidic acid, 2-chloroethyl phenyl ester
Database identifiers
- CAS
78218-72-1- PubChem CID
- 96193
- DTXSID
DTXSID901384844- Nikkaji
- J92.166A
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 298
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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