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Substance Name: Isophthalonitrile, 2,4,6-trimethyl-, N,N'-dioxide
RN: 15138-43-9
InChIKey: YZHOPEMIKZYPJE-UHFFFAOYSA-N

Molecular Formula

  • C11-H10-N2-O2

Molecular Weight

  • 202.212
 
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Names and Synonyms

Synonyms

  • 2,4,6-Trimethylisophthalonitrile N,N'-dioxide
  • BRN 3096014
  • Isophthalonitrile, 2,4,6-trimethyl-, N,N'-dioxide
  • NSC 93008

Systematic Names

  • 1,3-Benzenedicarbonitrile, 2,4,6-trimethyl-, N,N'-dioxide (9CI)
  • Isophthalonitrile, 2,4,6-trimethyl-, N,N'-dioxide

Registry Numbers

CAS Registry Number

  • 15138-43-9

System Generated Number

  • 0015138439

Structure Descriptors

InChI

1S/C11H10N2O2/c1-7-4-8(2)11(6-13-15)9(3)10(7)5-12-14/h4H,1-3H3

InChIKey

YZHOPEMIKZYPJE-UHFFFAOYSA-N

Smiles

c1(c(c(c(C)cc1C)C#[N+][O-])C)C#[N+][O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 5600ug/kg (5.6mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04582,