Benzoic acid, 2-ethoxy-4-methyl-, ethyl ester

CAS Registry Number®

88709-17-5
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CAS Name

Benzoic acid, 2-ethoxy-4-methyl-, ethyl ester

Molecular Formula

C12H16O3

Molecular Mass

208.25

Cite this Page

Benzoic acid, 2-ethoxy-4-methyl-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=88709-17-5 (retrieved 2024-08-12) (CAS RN: 88709-17-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    156 °C @ Press: 5 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H16O3/c1-4-14-11-8-9(3)6-7-10(11)12(13)15-5-2/h6-8H,4-5H2,1-3H3

InChIKey

InChIKey=PQLJVFJXXWBUPR-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OCC)C1=CC=C(C=C1OCC)C

Other Names for this Substance

  • Benzoic acid, 2-ethoxy-4-methyl-, ethyl ester
  • Ethyl 2-ethoxy-4-methylbenzoate