4-(1,1-Dimethylethyl)-α,α-dimethyl-γ-oxobenzenebutanoic acid

CAS Registry Number®

951893-29-1

CAS Name

4-(1,1-Dimethylethyl)-α,α-dimethyl-γ-oxobenzenebutanoic acid

Molecular Formula

C16H22O3

Molecular Mass

262.34

Cite this Page

4-(1,1-Dimethylethyl)-α,α-dimethyl-γ-oxobenzenebutanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=951893-29-1 (retrieved 2024-12-20) (CAS RN: 951893-29-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    193.1-194.2 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H22O3/c1-15(2,3)12-8-6-11(7-9-12)13(17)10-16(4,5)14(18)19/h6-9H,10H2,1-5H3,(H,18,19)

InChIKey

InChIKey=YUICPAZCDYDUFL-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenebutanoic acid, 4-(1,1-dimethylethyl)-α,α-dimethyl-γ-oxo-
  • 4-(1,1-Dimethylethyl)-α,α-dimethyl-γ-oxobenzenebutanoic acid

CAS INSIGHTSTM
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