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Substance Name: Malononitrile, 5-bromovanillylidene-
RN: 99972-15-3
InChIKey: RMTVRMJDCJSEMW-UHFFFAOYSA-N

Molecular Formula

  • C11-H7-Br-N2-O2

Molecular Weight

  • 279.092
 
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Names and Synonyms

Synonyms

  • 4-10-00-02306 (Beilstein Handbook Reference)
  • 5-Bromo vanillylidenemalononitrile
  • BRN 3324020

Systematic Name

  • Malononitrile, 5-bromovanillylidene-

Registry Numbers

CAS Registry Number

  • 99972-15-3

System Generated Number

  • 0099972153

Structure Descriptors

InChI

1S/C11H7BrN2O2/c1-16-10-4-7(2-8(5-13)6-14)3-9(12)11(10)15/h2-4,15H,1H3

InChIKey

RMTVRMJDCJSEMW-UHFFFAOYSA-N

Smiles

c1(cc(c(O)c(c1)Br)OC)\C=C(/C#N)C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#07642,