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Substance Name: p-Toluic acid, 2-bis(2-chloroethyl)amino-
RN: 6009-97-8
InChIKey: QNBUCFHYTAXDFW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H15-Cl2-N-O2

Molecular Weight

  • 276.161
 
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Names and Synonyms

Synonyms

  • 2-Bis(2-chloroethyl)amino-4-methylbenzoic acid
  • 2-Bis(2-chloroethyl)amino-p-toluic acid
  • Acidul 2,N,N-di-(2-cloretil)amino-4-metilbenzoic
  • Acidul 2,N,N-di-(2-cloretil)amino-4-metilbenzoic [Romanian]
  • Benzoic acid, 2-bis(2-chloroethyl)amino-4-methyl-
  • BRN 3096193

Systematic Name

  • p-Toluic acid, 2-bis(2-chloroethyl)amino-

Registry Numbers

CAS Registry Number

  • 6009-97-8

System Generated Number

  • 0006009978

Structure Descriptors

InChI

1S/C12H15Cl2NO2/c1-9-2-3-10(12(16)17)11(8-9)15(6-4-13)7-5-14/h2-3,8H,4-7H2,1H3,(H,16,17)

InChIKey

QNBUCFHYTAXDFW-UHFFFAOYSA-N

Smiles

C(c1c(cc(cc1)C)N(CCCl)CCCl)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 25mg/kg (25mg/kg)   Farmacia Vol. 17, Pg. 473, 1969.
rat LD50 unreported 20mg/kg (20mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 500, 1968.