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Substance Name: Pyruvic acid, 3-(p-(bis(2-chloroethyl)amino)phenyl)-
RN: 4213-31-4
InChIKey: MGZHFKFYFIKVPL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H15-Cl2-N-O3

Molecular Weight

  • 304.172
 
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Names and Synonyms

Synonyms

  • 3-(p-(Bis(2-chloroethyl)amino)phenyl)pyruvic acid
  • BRN 3101279
  • MP 675
  • NSC 48613
  • Pyruvic acid, (p-(bis(2-chloroethyl)amino)phenyl)-

Systematic Names

  • Pyruvic acid, (p-(bis(2-chloroethyl)amino)phenyl)- (8CI)
  • Pyruvic acid, 3-(p-(bis(2-chloroethyl)amino)phenyl)-

Registry Numbers

CAS Registry Number

  • 4213-31-4

System Generated Number

  • 0004213314

Structure Descriptors

InChI

1S/C13H15Cl2NO3/c14-5-7-16(8-6-15)11-3-1-10(2-4-11)9-12(17)13(18)19/h1-4H,5-9H2,(H,18,19)

InChIKey

MGZHFKFYFIKVPL-UHFFFAOYSA-N

Smiles

C(C(Cc1ccc(cc1)N(CCCl)CCCl)=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD10 intraperitoneal 13mg/kg (13mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 741, 1965.