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Substance Name: 2H-1,3-Benzoxazine-3(4H)-acetonitrile, 2-oxo-
RN: 18464-45-4
InChIKey: MJCDPTXGBVZWID-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H8-N2-O2

Molecular Weight

  • 188.185
 
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Names and Synonyms

Synonyms

  • 2-Oxo-2H-1,3-benzoxazine-3(4H)-acetonitrile
  • BRN 1112559

Systematic Name

  • 2H-1,3-Benzoxazine-3(4H)-acetonitrile, 2-oxo-

Registry Numbers

CAS Registry Number

  • 18464-45-4

System Generated Number

  • 0018464454

Structure Descriptors

InChI

1S/C10H8N2O2/c11-5-6-12-7-8-3-1-2-4-9(8)14-10(12)13/h1-4H,6-7H2

InChIKey

MJCDPTXGBVZWID-UHFFFAOYSA-N

Smiles

O1C(N(Cc2c1cccc2)CC#N)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1gm/kg (1000mg/kg)   Experientia. Vol. 24, Pg. 774, 1968.