4-(1,1-Dimethylethyl)-β-methyl-δ-oxobenzenepentanoic acid

CAS Registry Number®

845781-47-7
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CAS Name

4-(1,1-Dimethylethyl)-β-methyl-δ-oxobenzenepentanoic acid

Molecular Formula

C16H22O3

Molecular Mass

262.34

Cite this Page

4-(1,1-Dimethylethyl)-β-methyl-δ-oxobenzenepentanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=845781-47-7 (retrieved 2024-07-31) (CAS RN: 845781-47-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H22O3/c1-11(10-15(18)19)9-14(17)12-5-7-13(8-6-12)16(2,3)4/h5-8,11H,9-10H2,1-4H3,(H,18,19)

InChIKey

InChIKey=NPXVVJVOXBGDSA-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenepentanoic acid, 4-(1,1-dimethylethyl)-β-methyl-δ-oxo-
  • 4-(1,1-Dimethylethyl)-β-methyl-δ-oxobenzenepentanoic acid