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Substance Name: Benzoic acid, 4-isocyano-, ethyl ester
RN: 1983-99-9
InChIKey: AUCNDAZBLKMEEM-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Insecticide

Molecular Formula

  • C10-H9-N-O2

Molecular Weight

  • 175.186
 
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Names and Synonyms

Synonyms

  • Benzoic acid, p-isocyano-, ethyl ester
  • Ethyl 4-isocyanobenzoate

Systematic Name

  • Benzoic acid, 4-isocyano-, ethyl ester

Registry Numbers

CAS Registry Number

  • 1983-99-9

System Generated Number

  • 0001983999

Structure Descriptors

InChI

1S/C10H9NO2/c1-3-13-10(12)8-4-6-9(11-2)7-5-8/h4-7H,3H2,1H3

InChIKey

AUCNDAZBLKMEEM-UHFFFAOYSA-N

Smiles

c1(ccc([N+]#[C-])cc1)C(OCC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 5gm/kg (5000mg/kg)   United States Patent Document. Vol. #3422190,
mouse LD subcutaneous > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #3422190,