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Substance Name: 1-Propanol, 3-((2-((2-chloroethyl)amino)ethyl)amino)-, dihydrogen phosphate (ester), dihydrochloride
RN: 158401-51-5
InChIKey: OTNQBDJOMAOTIE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H18-Cl-N2-O4-P.2Cl-H

Molecular Weight

  • 333.578
 
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Names and Synonyms

  • 1-Propanol, 3-((2-((2-chloroethyl)amino)ethyl)amino)-, dihydrogen phosphate (ester), dihydrochloride

Registry Numbers

CAS Registry Number

  • 158401-51-5

System Generated Number

  • 0158401515

Molecular Formulas

Molecular Formula

  • C7-H18-Cl-N2-O4-P.2Cl-H

Molecular Formula Fragments

  • C7-H18-Cl-N2-O4-P
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C7H18ClN2O4P.2ClH/c8-2-4-10-6-5-9-3-1-7-14-15(11,12)13;;/h9-10H,1-7H2,(H2,11,12,13);2*1H

InChIKey

OTNQBDJOMAOTIE-UHFFFAOYSA-N

Smiles

C(CNCCNCCCl)COP(=O)(O)O.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 700mg/kg (700mg/kg)   Journal of Medicinal Chemistry. Vol. 37, Pg. 3986, 1994.