2-chloro-N-(2-chloroethyl)-N-[morpholin-4-yl(phenylmethoxy)phosphoryl]ethanamine

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Basic information

CAS: 18228-83-6
Standard SMILES: O=P(OCc1ccccc1)(N(CCCl)CCCl)N1CCOCC1
InChIKey: JDQXHQOVJGOUKN-UHFFFAOYSA-N
Molecular formula: C15H23Cl2N2O3P
Average molar mass: 381.2 g/mol
Monoisotopic mass: 380.082335

Names & identifiers

Preferred name: 2-chloro-N-(2-chloroethyl)-N-[morpholin-4-yl(phenylmethoxy)phosphoryl]ethanamine
IUPAC: 2-chloro-N-(2-chloroethyl)-N-[morpholin-4-yl(phenylmethoxy)phosphoryl]ethanamine

Names & synonyms

NSC7495918228-83-6DTXSID60328979NSC-74959Benzyl N,N-bis(2-chloroethyl)-P-(morpholin-4-yl)phosphonamidatePhosphonamidic acid,N-bis(2-chloroethyl)-P-morpholino-, benzyl ester

Database identifiers

CAS: 18228-83-6
PubChem CID: 416006
DTXSID: DTXSID60328979

Properties

Computed structural properties

XLogP: 2.2
Topological polar surface area: 42 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 9
Heavy atoms: 23
Formal charge: 0
Complexity: 372

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