Methyl 4-(pentyloxy)benzoate

CAS Registry Number®

5416-97-7

CAS Name

Methyl 4-(pentyloxy)benzoate

Molecular Formula

C13H18O3

Molecular Mass

222.28

Cite this Page

Methyl 4-(pentyloxy)benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5416-97-7 (retrieved 2025-01-20) (CAS RN: 5416-97-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    176-178 °C @ Press: 14 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H18O3/c1-3-4-5-10-16-12-8-6-11(7-9-12)13(14)15-2/h6-9H,3-5,10H2,1-2H3

InChIKey

InChIKey=PMQWMUPLNBYIBS-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 4-(pentyloxy)-, methyl ester
  • Benzoic acid, p-(pentyloxy)-, methyl ester
  • Methyl 4-(pentyloxy)benzoate
  • Methyl 4-pentoxybenzoate
  • NSC 7330