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Substance Name: Urea, 1,1'-(4-methyl-m-phenylene)bis(1-(2-chloroethyl)-
RN: 60984-07-8
InChIKey: WROOVDGVVQEBLC-UHFFFAOYSA-N

Molecular Formula

  • C13-H18-Cl2-N4-O2.H2-O

Molecular Weight

  • 333.2172
 
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Names and Synonyms

Synonyms

  • 1,1'-Bis(2-chloroethyl)-3,3'-(4-methyl-m-phenylene)diurea comp. with water
  • reaction product of 3,3'-(2,4-Tolylene)bis(1-(2-chloroethyl)urea)and water
  • Urea, 3,3'-(4-methyl-m-phenylene)bis(1-chloroethyl)-di- comp. with water

Systematic Name

  • Urea, 1,1'-(4-methyl-m-phenylene)bis(1-(2-chloroethyl)-

Registry Numbers

CAS Registry Number

  • 60984-07-8

System Generated Number

  • 0060984078

Molecular Formulas

Molecular Formula

  • C13-H18-Cl2-N4-O2.H2-O

Molecular Formula Fragments

  • C13-H18-Cl2-N4-O2
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C13H18Cl2N4O2/c1-9-2-3-10(18-12(20)16-6-4-14)8-11(9)19-13(21)17-7-5-15/h2-3,8H,4-7H2,1H3,(H2,16,18,20)(H2,17,19,21)

InChIKey

WROOVDGVVQEBLC-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1NC(=O)NCCCl)NC(=O)NCCCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 75mg/kg (75mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08615,