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Substance Name: 2-Methoxy-5-methyl-1,4-benzoquinone
RN: 614-13-1
UNII: 65F6O8111V
InChIKey: VJVOAGLABGZRSL-UHFFFAOYSA-N

Note

  • Thromboxane A2 receptor antagonist; from Lentinus adhaerens.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H8-O3

Molecular Weight

  • 152.1482
 
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Names and Synonyms

Name of Substance

  • 2-Methoxy-5-methyl-1,4-benzoquinone

Synonyms

  • 2-Methyl-5-methoxy-p-benzoquinone
  • 2-Methyl-5-methoxyquinone
  • 4-08-00-01787 (Beilstein Handbook Reference)
  • 4-Methoxy-2,5-toluquinone
  • 4-Methoxytoluquinone
  • 5-Methoxy-p-toluquinone
  • 5-Methoxytoluquinone
  • AI3-25004
  • BRN 0972398
  • Coprinin
  • NSC 3071
  • Toluquinone, 5-methoxy-
  • UNII-65F6O8111V

Systematic Names

  • 2,5-Cyclohexadiene-1,4-dione, 2-methoxy-5-methyl- (9CI)
  • p-Benzoquinone, 2-methoxy-5-methyl-

Registry Numbers

CAS Registry Number

  • 614-13-1

FDA UNII

  • 65F6O8111V

System Generated Number

  • 0000614131

Structure Descriptors

InChI

1S/C8H8O3/c1-5-3-7(10)8(11-2)4-6(5)9/h3-4H,1-2H3

InChIKey

VJVOAGLABGZRSL-UHFFFAOYSA-N

Smiles

CC1=CC(=O)C(=CC1=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 25mg/kg (25mg/kg)   Proceedings of the National Academy of Sciences of the United States of America. Vol. 34, Pg. 498, 1948.