3-(1,1-Dimethylethyl)-4-methoxybenzoic acid

CAS Registry Number®

66737-89-1
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CAS Name

3-(1,1-Dimethylethyl)-4-methoxybenzoic acid

Molecular Formula

C12H16O3

Molecular Mass

208.25

Cite this Page

3-(1,1-Dimethylethyl)-4-methoxybenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=66737-89-1 (retrieved 2024-09-01) (CAS RN: 66737-89-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    193-194 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H16O3/c1-12(2,3)9-7-8(11(13)14)5-6-10(9)15-4/h5-7H,1-4H3,(H,13,14)

InChIKey

InChIKey=WXQUGIVHDANZTM-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 3-(1,1-dimethylethyl)-4-methoxy-
  • 3-(1,1-Dimethylethyl)-4-methoxybenzoic acid
  • 3-tert-Butyl-4-methoxybenzoic acid