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Substance Name: 2,5-Diaminotropone
RN: 36039-40-4
InChIKey: SNFONUQYPBCAIH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H8-N2-O

Molecular Weight

  • 136.153
 
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Names and Synonyms

Name of Substance

  • 2,5-Diaminotropone

Synonyms

  • 2,5-Diamino-2,4,6-cycloheptatrien-1-one
  • 2,5-Diaminotropone
  • 4-14-00-00041 (Beilstein Handbook Reference)
  • BRN 2802378

Systematic Name

  • 2,4,6-Cycloheptatrien-1-one, 2,5-diamino-

Registry Numbers

CAS Registry Number

  • 36039-40-4

System Generated Number

  • 0036039404

Structure Descriptors

InChI

1S/C7H8N2O/c8-5-1-3-6(9)7(10)4-2-5/h1-4H,8H2,(H2,9,10)

InChIKey

SNFONUQYPBCAIH-UHFFFAOYSA-N

Smiles

c1(c(ccc(cc1)N)=O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 174mg/kg (174mg/kg) BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
Chemical and Pharmaceutical Bulletin. Vol. 20, Pg. 60, 1972.
mouse LD50 intravenous 192mg/kg (192mg/kg) BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
Chemical and Pharmaceutical Bulletin. Vol. 20, Pg. 60, 1972.
mouse LD50 subcutaneous 361mg/kg (361mg/kg) BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
Chemical and Pharmaceutical Bulletin. Vol. 20, Pg. 60, 1972.