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Substance Name: 1-(4-Carboxyethylphenyl)-3,3-dimethyltriazene
RN: 21600-51-1
InChIKey: PDOLRHLZGYQIGP-OUKQBFOZSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C11-H15-N3-O2

Molecular Weight

  • 221.258
 
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Names and Synonyms

Name of Substance

  • 1-(4-Carboxyethylphenyl)-3,3-dimethyltriazene

Synonyms

  • 1(4-Carbethoxyphenyl)-3,3-dimethyltriazene
  • 1-(p-Carbethoxyphenyl)-3,3-dimethyltriazine
  • 1-(p-Carboxyaetylphenyl)-3,3-dimethyltriazen
  • 1-(p-Carboxyaetylphenyl)-3,3-dimethyltriazen [German]
  • 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene
  • AT 2052
  • Benzoic acid, p-(3-dimethyltriazeno)-, ethyl ester
  • Ethyl 4-(3,3-dimethyl-1-triazenyl)benzoate
  • NSC 86445
  • Triazene, 1-(p-ethylcarboxyphenyl)-3,3-dimethyl-

Systematic Names

  • Benzoic acid, 4-(3,3-dimethyl-1-triazenyl)-, ethyl ester (9CI)
  • Benzoic acid, p-(3,3-dimethyl-1-triazeno)-, ethyl ester (8CI)
  • Benzoic acid, p-(3-dimethyltriazeno)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 21600-51-1

System Generated Number

  • 0021600511

Structure Descriptors

InChI

1S/C11H15N3O2/c1-4-16-11(15)9-5-7-10(8-6-9)12-13-14(2)3/h5-8H,4H2,1-3H3/b13-12+

InChIKey

PDOLRHLZGYQIGP-OUKQBFOZSA-N

Smiles

c1(ccc(\N=N\N(C)C)cc1)C(OCC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2gm/kg (2000mg/kg)   French Demande Patent Document. Vol. #2011475,
rat LD50 intravenous 150mg/kg (150mg/kg) PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE Arzneimittel-Forschung. Drug Research. Vol. 23, Pg. 800, 1973.
rat LD50 subcutaneous 450mg/kg (450mg/kg) BLOOD: LEUKOPENIA

BLOOD: THROMBOCYTOPENIA
Arzneimittel-Forschung. Drug Research. Vol. 23, Pg. 800, 1973.