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Substance Name: p-Toluenesulfonic acid, 3-(bis(2-chloroethyl)amino-
RN: 19768-75-3
InChIKey: DWUOZVCWMPJABS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H15-Cl2-N-O3-S

Molecular Weight

  • 312.216
 
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Names and Synonyms

Synonyms

  • 3-(Bis(2-chloroethyl)amino)-4-methylphenyl sulfonic acid
  • 3-Bis(2-chloroethyl)amino-p-toluenesulfonic acid
  • BRN 3098677

Systematic Name

  • p-Toluenesulfonic acid, 3-(bis(2-chloroethyl)amino-

Registry Numbers

CAS Registry Number

  • 19768-75-3

System Generated Number

  • 0019768753

Structure Descriptors

InChI

1S/C11H15Cl2NO3S/c1-9-2-3-10(18(15,16)17)8-11(9)14(6-4-12)7-5-13/h2-3,8H,4-7H2,1H3,(H,15,16,17)

InChIKey

DWUOZVCWMPJABS-UHFFFAOYSA-N

Smiles

S(c1cc(N(CCCl)CCCl)c(cc1)C)(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 200mg/kg (200mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 161, 1969.
rat LD50 unreported 200mg/kg (200mg/kg)   Cancer Treatment Reports. Vol. 62, Pg. 2045, 1978.