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Substance Name: 2H-1-Benzopyran, 2,2-dimethyl-3-nitro-
RN: 57544-29-3
InChIKey: DCZZXWWSCKHUHN-UHFFFAOYSA-N

Molecular Formula

  • C11-H11-N-O3

Molecular Weight

  • 205.212
 
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Names and Synonyms

Synonyms

  • 2,2-Dimethyl-3-nitro-2H-1-benzopyran
  • 5-17-02-00059 (Beilstein Handbook Reference)
  • BRN 1620473

Systematic Name

  • 2H-1-Benzopyran, 2,2-dimethyl-3-nitro-

Registry Numbers

CAS Registry Number

  • 57544-29-3

System Generated Number

  • 0057544293

Structure Descriptors

InChI

1S/C11H11NO3/c1-11(2)10(12(13)14)7-8-5-3-4-6-9(8)15-11/h3-7H,1-2H3

InChIKey

DCZZXWWSCKHUHN-UHFFFAOYSA-N

Smiles

c12c(OC(C)(C)C(=C1)[N+](=O)[O-])cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 700mg/kg (700mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 81, 1976.