4-(1,1-Dimethylethyl)-ζ-oxobenzeneheptanoic acid

CAS Registry Number®

898791-45-2
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CAS Name

4-(1,1-Dimethylethyl)-ζ-oxobenzeneheptanoic acid

Molecular Formula

C17H24O3

Molecular Mass

276.37

Cite this Page

4-(1,1-Dimethylethyl)-ζ-oxobenzeneheptanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=898791-45-2 (retrieved 2024-09-08) (CAS RN: 898791-45-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H24O3/c1-17(2,3)14-11-9-13(10-12-14)15(18)7-5-4-6-8-16(19)20/h9-12H,4-8H2,1-3H3,(H,19,20)

InChIKey

InChIKey=WADGTQNUTOISTD-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzeneheptanoic acid, 4-(1,1-dimethylethyl)-ζ-oxo-
  • 4-(1,1-Dimethylethyl)-ζ-oxobenzeneheptanoic acid