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Substance Name: 6-Trifluoromethylcyclophosphamide
RN: 57165-71-6
InChIKey: KJCIGHRTQNBIGS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H14-Cl2-F3-N2-O2-P

Molecular Weight

  • 329.0846
 
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Names and Synonyms

Results Name

  • 6-Trifluoromethylcyclophosphamide

Synonyms

  • 2-(Bis(2-chloroethyl)amino)-6-trifluoromethyltetrahydro-2H-1,3,2-oxazaphosphorine 2-oxide
  • 6-Trifluoromethylcyclophosphamide
  • BRN 1002990

Systematic Name

  • 2H-1,3,2-Oxazaphosphorine, tetrahydro-2-(bis(2-chloroethyl)amino)-6-trifluoromethyl-, 2-oxide

Registry Numbers

CAS Registry Number

  • 57165-71-6

System Generated Number

  • 0057165716

Structure Descriptors

InChI

1S/C8H14Cl2F3N2O2P/c9-2-5-15(6-3-10)18(16)14-4-1-7(17-18)8(11,12)13/h7H,1-6H2,(H,14,16)

InChIKey

KJCIGHRTQNBIGS-UHFFFAOYSA-N

Smiles

C1CNP(=O)(OC1C(F)(F)F)N(CCCl)CCCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 1106, 1975.
rat LD50 intraperitoneal 224mg/kg (224mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 1106, 1975.