β-Methyl-δ-oxo-1,3-benzodioxole-5-pentanoic acid

CAS Registry Number®

951894-10-3

CAS Name

β-Methyl-δ-oxo-1,3-benzodioxole-5-pentanoic acid

Molecular Formula

C13H14O5

Molecular Mass

250.25

Cite this Page

β-Methyl-δ-oxo-1,3-benzodioxole-5-pentanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=951894-10-3 (retrieved 2024-11-28) (CAS RN: 951894-10-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H14O5/c1-8(5-13(15)16)4-10(14)9-2-3-11-12(6-9)18-7-17-11/h2-3,6,8H,4-5,7H2,1H3,(H,15,16)

InChIKey

InChIKey=AIOFZPLOCHZISL-UHFFFAOYSA-N

SMILES

C(CC(CC(O)=O)C)(=O)C=1C=C2C(=CC1)OCO2

Canonical SMILES

O=C(O)CC(C)CC(=O)C1=CC=C2OCOC2=C1

Other Names for this Substance

  • 1,3-Benzodioxole-5-pentanoic acid, β-methyl-δ-oxo-
  • β-Methyl-δ-oxo-1,3-benzodioxole-5-pentanoic acid

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