Benzoic acid, 4-pentyl-, methyl ester

CAS Registry Number®

26311-44-4

CAS Name

Benzoic acid, 4-pentyl-, methyl ester

Molecular Formula

C13H18O2

Molecular Mass

206.28

Cite this Page

Benzoic acid, 4-pentyl-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=26311-44-4 (retrieved 2024-11-25) (CAS RN: 26311-44-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H18O2/c1-3-4-5-6-11-7-9-12(10-8-11)13(14)15-2/h7-10H,3-6H2,1-2H3

InChIKey

InChIKey=STDGBCHZHMQCAE-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 4-pentyl-, methyl ester
  • Benzoic acid, p-pentyl-, methyl ester
  • Methyl 4-pentylbenzoate

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