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Substance Name: Chlorimine picryl sulfonate
RN: 547-95-5
InChIKey: CODNXQDQAPZBMO-UHFFFAOYSA-N

Classification Code

  • Human Data

Molecular Formula

  • C5-H11-Cl-N.C6-H2-N3-O9-S

Molecular Weight

  • 412.762
 
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Names and Synonyms

Results Name

  • Chlorimine picryl sulfonate

Synonyms

  • 1-(2-Chloroethyl)-1-methylaziridinium 2,4,6-trinitrobenzenesulfonate
  • 1-Methyl-1-(beta-chloroethyl)ethylenimonium picrylsulfonate
  • Aziridinium, 1-(2-chloroethyl)-1-methyl-, 2,4,6-trinitrobenzenesulfonate
  • Chlorimine picryl sulfonate
  • Methyl-beta-chloroethyl-ethylenimonium picrylsulfonate

Systematic Name

  • Ethylenimonium, methyl(2-chloroethyl)-, picrylsulfonate

Registry Numbers

CAS Registry Number

  • 547-95-5

System Generated Number

  • 0000547955

Molecular Formulas

Molecular Formula

  • C5-H11-Cl-N.C6-H2-N3-O9-S

Molecular Formula Fragments

  • C5-H11-Cl-N
  • C6-H2-N3-O9-S
  • COMPONENT

Structure Descriptors

InChI

1S/C6H3N3O9S.C5H10ClN/c10-7(11)3-1-4(8(12)13)6(19(16,17)18)5(2-3)9(14)15;6-2-1-3-7-4-5-7/h1-2H,(H,16,17,18);1-5H2

InChIKey

CODNXQDQAPZBMO-UHFFFAOYSA-N

Smiles

c1(c(cc([N+](=O)[O-])cc1[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-].[NH+]1(CC1)CCCCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
human TDLo intravenous 800ug/kg (0.8mg/kg) BLOOD: THROMBOCYTOPENIA

GASTROINTESTINAL: NAUSEA OR VOMITING

BLOOD: LEUKOPENIA
Clinical Pharmacology and Therapeutics Vol. 6, Pg. 50, 1965.
mouse LD50 intravenous 1500ug/kg (1.5mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 91, Pg. 224, 1947.
mouse LD50 subcutaneous 2400ug/kg (2.4mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 91, Pg. 224, 1947.
rabbit LDLo intravenous 2mg/kg (2mg/kg) BLOOD: LEUKOPENIA Clinical Pharmacology and Therapeutics Vol. 6, Pg. 50, 1965.
rat LDLo intravenous 2mg/kg (2mg/kg)   Clinical Pharmacology and Therapeutics Vol. 6, Pg. 50, 1965.
rat LDLo intravenous 2mg/kg (2mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: ATAXIA
Clinical Pharmacology and Therapeutics Vol. 6, Pg. 50, 1965.