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Substance Name: Urea, N-(2-(bis(2-chloroethyl)amino)tetrahydro-2H-1,3,2-oxazaphosphorin-4-yl)-N-hydroxy-N'-(4-nitrophenyl)-, P-oxide
RN: 97139-36-1
InChIKey: IUODTNOTPYKXQK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H20-Cl2-N5-O6-P

Molecular Weight

  • 456.221
 
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Names and Synonyms

  • Urea, N-(2-(bis(2-chloroethyl)amino)tetrahydro-2H-1,3,2-oxazaphosphorin-4-yl)-N-hydroxy-N'-(4-nitrophenyl)-, P-oxide

Registry Numbers

CAS Registry Number

  • 97139-36-1

System Generated Number

  • 0097139361

Structure Descriptors

InChI

1S/C14H20Cl2N5O6P/c15-6-8-19(9-7-16)28(26)18-13(5-10-27-28)20(23)14(22)17-11-1-3-12(4-2-11)21(24)25/h1-4,13,23H,5-10H2,(H,17,22)(H,18,26)

InChIKey

IUODTNOTPYKXQK-UHFFFAOYSA-N

Smiles

ON(C1CCOP(=O)(N1)N(CCCl)CCCl)C(=O)Nc2ccc(cc2)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4618692,