Benzoic acid, 4-methoxy-, 2-methylpropyl ester

CAS Registry Number®

27739-28-2

CAS Name

Benzoic acid, 4-methoxy-, 2-methylpropyl ester

Molecular Formula

C12H16O3

Molecular Mass

208.25

Cite this Page

Benzoic acid, 4-methoxy-, 2-methylpropyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=27739-28-2 (retrieved 2025-05-20) (CAS RN: 27739-28-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    170 °C @ Press: 46 Torr

  • Density (1)

    1.052 g/cm³ @ Temp: 16.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H16O3/c1-9(2)8-15-12(13)10-4-6-11(14-3)7-5-10/h4-7,9H,8H2,1-3H3

InChIKey

InChIKey=HQYSDZUOGBUYJA-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 4-methoxy-, 2-methylpropyl ester
  • p-Anisic acid, isobutyl ester
  • Anisic acid, isobutyl
  • p-Methoxybenzoic acid isobutyl ester
  • Isobutyl 4-methoxybenzoate

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Deleted or Replaced CAS Registry Numbers

71685-96-6

CAS INSIGHTSTM
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