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Substance Name: 2H-1-Benzopyran-3-carbonitrile, 2-methyl-
RN: 57543-73-4
InChIKey: SFTWTNJNZKFQLN-UHFFFAOYSA-N

Molecular Formula

  • C11-H9-N-O

Molecular Weight

  • 171.198
 
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Names and Synonyms

Synonyms

  • 2-Methyl-2H-1-benzopyran-3-carbonitrile
  • BRN 1368868

Systematic Name

  • 2H-1-Benzopyran-3-carbonitrile, 2-methyl-

Registry Numbers

CAS Registry Number

  • 57543-73-4

System Generated Number

  • 0057543734

Structure Descriptors

InChI

1S/C11H9NO/c1-8-10(7-12)6-9-4-2-3-5-11(9)13-8/h2-6,8H,1H3

InChIKey

SFTWTNJNZKFQLN-UHFFFAOYSA-N

Smiles

c12c(O[C@@H](C)C(=C1)C#N)cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 900mg/kg (900mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 81, 1976.