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Substance Name: Benzoic acid, 3-(bis(2-chloroethyl)amino)-2,4-dimethyl-
RN: 24830-45-3
InChIKey: HRDXLCGXZZRIQG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H17-Cl2-N-O2

Molecular Weight

  • 290.188
 
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Names and Synonyms

Synonyms

  • 3-(Bis(2-chloroethyl)amino)-2,4-dimethylbenzoic acid
  • BRN 2746445

Systematic Name

  • Benzoic acid, 3-(bis(2-chloroethyl)amino)-2,4-dimethyl-

Registry Numbers

CAS Registry Number

  • 24830-45-3

System Generated Number

  • 0024830453

Structure Descriptors

InChI

1S/C13H17Cl2NO2/c1-9-3-4-11(13(17)18)10(2)12(9)16(7-5-14)8-6-15/h3-4H,5-8H2,1-2H3,(H,17,18)

InChIKey

HRDXLCGXZZRIQG-UHFFFAOYSA-N

Smiles

c1(N(CCCl)CCCl)c(c(ccc1C)C(O)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 unreported 15mg/kg (15mg/kg)   Neoplasma. Vol. 27, Pg. 271, 1980.