Benzoic acid, 4-butoxy-3-methoxy-, methyl ester

CAS Registry Number®

3535-28-2
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CAS Name

Benzoic acid, 4-butoxy-3-methoxy-, methyl ester

Molecular Formula

C13H18O4

Molecular Mass

238.28

Cite this Page

Benzoic acid, 4-butoxy-3-methoxy-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3535-28-2 (retrieved 2024-08-11) (CAS RN: 3535-28-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    46-48 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H18O4/c1-4-5-8-17-11-7-6-10(13(14)16-3)9-12(11)15-2/h6-7,9H,4-5,8H2,1-3H3

InChIKey

InChIKey=UOSGRNUALUSRJX-UHFFFAOYSA-N

SMILES

O(CCCC)C1=C(OC)C=C(C(OC)=O)C=C1

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 4-butoxy-3-methoxy-, methyl ester
  • 4-Butoxy-3-methoxybenzoic acid methyl ester
  • Methyl 4-butoxy-3-methoxybenzoate