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Substance Name: p-Toluenephosphonic acid, 3-(bis(2-chloroethyl)amino)-
RN: 19768-76-4
InChIKey: BIOHVRABGYPFNT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-Cl2-N-O3-P

Molecular Weight

  • 312.131
 
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Names and Synonyms

Synonyms

  • 3-(Bis(2-chloroethyl)amino)-p-toluenephosphonic acid
  • BRN 3098517

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 19768-76-4

System Generated Number

  • 0019768764

Structure Descriptors

InChI

1S/C11H16Cl2NO3P/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,(H2,15,16,17)

InChIKey

BIOHVRABGYPFNT-UHFFFAOYSA-N

Smiles

c1(cc(c(cc1)C)N(CCCl)CCCl)P(=O)(O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 72mg/kg (72mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 161, 1969.
rat LD50 unreported 72mg/kg (72mg/kg)   Cancer Treatment Reports. Vol. 62, Pg. 2045, 1978.