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Substance Name: 1,3-Propanediamine, N-hexyl-N'-(1-nitro-9-acridinyl)-, dihydrochloride
RN: 77280-91-2
InChIKey: JEWVXBXBNITZRB-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C22-H28-N4-O2.2Cl-H

Molecular Weight

  • 453.411
 
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Names and Synonyms

Synonyms

  • 1-Nitro-9-(3-hexylaminopropylamino)acridine dihydrochloride
  • 9-((3-(Hexylamino)propyl)amino)-1-nitroacridine dihydrochloride
  • Acridine, 9-((3-(hexylamino)propyl)amino)-1-nitro-, dihydrochloride
  • C 1006

Systematic Name

  • 1,3-Propanediamine, N-hexyl-N'-(1-nitro-9-acridinyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 77280-91-2

System Generated Number

  • 0077280912

Molecular Formulas

Molecular Formula

  • C22-H28-N4-O2.2Cl-H

Molecular Formula Fragments

  • C22-H28-N4-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H28N4O2.2ClH/c1-2-3-4-7-14-23-15-9-16-24-22-17-10-5-6-11-18(17)25-19-12-8-13-20(21(19)22)26(27)28;;/h5-6,8,10-13,23H,2-4,7,9,14-16H2,1H3,(H,24,25);2*1H

InChIKey

JEWVXBXBNITZRB-UHFFFAOYSA-N

Smiles

C(CCNc1c2ccccc2nc2cccc(c12)[N+](=O)[O-])NCCCCCC.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 3820ug/kg (3.82mg/kg)   Archivum Immunologiae et Therapiae Experimentalis. Vol. 30, Pg. 385, 1982.
pigeon LD50 intravenous 10500ug/kg (10.5mg/kg) GASTROINTESTINAL: NAUSEA OR VOMITING Archivum Immunologiae et Therapiae Experimentalis. Vol. 28, Pg. 777, 1980.