3-Methyl-2-(3-methylbutyl)-6-benzofurancarboxylic acid

CAS Registry Number®

1313712-07-0

CAS Name

3-Methyl-2-(3-methylbutyl)-6-benzofurancarboxylic acid

Molecular Formula

C15H18O3

Molecular Mass

246.30

Cite this Page

3-Methyl-2-(3-methylbutyl)-6-benzofurancarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1313712-07-0 (retrieved 2024-12-04) (CAS RN: 1313712-07-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H18O3/c1-9(2)4-7-13-10(3)12-6-5-11(15(16)17)8-14(12)18-13/h5-6,8-9H,4,7H2,1-3H3,(H,16,17)

InChIKey

InChIKey=PLDCIRZIXZQVGV-UHFFFAOYSA-N

SMILES

CC=1C=2C(OC1CCC(C)C)=CC(C(O)=O)=CC2

Canonical SMILES

O=C(O)C=1C=CC2=C(OC(=C2C)CCC(C)C)C1

Other Names for this Substance

  • 6-Benzofurancarboxylic acid, 3-methyl-2-(3-methylbutyl)-
  • 3-Methyl-2-(3-methylbutyl)-6-benzofurancarboxylic acid
  • Aspergillusene B

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