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Substance Name: 7-Benzofurancarboxylic acid, 2,3-dihydro-2-methyl-
RN: 31457-03-1
InChIKey: HWCCVMGTQFWJSS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H10-O3

Molecular Weight

  • 178.186
 
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Names and Synonyms

Synonyms

  • 2,3-Dihydro-2-methyl-7-benzofurancarboxylic acid
  • 3-Methyl-1,3-dihydroisobenzofuran-1-carboxylic acid
  • 5-18-06-00391 (Beilstein Handbook Reference)
  • BRN 0163414

Systematic Name

  • 7-Benzofurancarboxylic acid, 2,3-dihydro-2-methyl-

Registry Numbers

CAS Registry Number

  • 31457-03-1

System Generated Number

  • 0031457031

Structure Descriptors

InChI

1S/C10H10O3/c1-6-5-7-3-2-4-8(10(11)12)9(7)13-6/h2-4,6H,5H2,1H3,(H,11,12)

InChIKey

HWCCVMGTQFWJSS-UHFFFAOYSA-N

Smiles

c12c(C(=O)O)cccc2C[C@@H](O1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 23, Pg. 1261, 1984.