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Substance Name: 1,6-Hexanediamine, N,N'-bis(2-chloroethyl)-N,N'-dimethyl-, N,N'-dioxide
RN: 101914-00-5
InChIKey: MNEZRKBUSNQRTK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H26-Cl2-N2-O2

Molecular Weight

  • 301.255
 
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Names and Synonyms

Synonyms

  • 4-04-00-01324 (Beilstein Handbook Reference)
  • BRN 1713153
  • N,N'-Bis(2-chloroethyl)-N,N'-dimethyl-1,6-hexanediamine N,N'-dioxide

Systematic Name

  • 1,6-Hexanediamine, N,N'-bis(2-chloroethyl)-N,N'-dimethyl-, N,N'-dioxide

Registry Numbers

CAS Registry Number

  • 101914-00-5

System Generated Number

  • 0101914005

Structure Descriptors

InChI

1S/C12H26Cl2N2O2/c1-15(17,11-7-13)9-5-3-4-6-10-16(2,18)12-8-14/h3-12H2,1-2H3

InChIKey

MNEZRKBUSNQRTK-UHFFFAOYSA-N

Smiles

C([N@@+](CCCl)(C)[O-])CCCCC[N@@+](CCCl)(C)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 750mg/kg (750mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 6, Pg. 169, 1958.