Isobutyl salicylate

CAS Registry Number®

87-19-4

CAS Name

Isobutyl salicylate

Molecular Formula

C11H14O3

Molecular Mass

194.23

Cite this Page

Isobutyl salicylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=87-19-4 (retrieved 2024-11-22) (CAS RN: 87-19-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    261 °C

  • Melting Point (1)

    5.9 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C11H14O3/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8,12H,7H2,1-2H3

InChIKey

InChIKey=PTXDBYSCVQQBNF-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OCC(C)C)C=1C=CC=CC1O

Other Names for this Substance

  • Benzoic acid, 2-hydroxy-, 2-methylpropyl ester
  • Salicylic acid, isobutyl ester
  • Isobutyl o-hydroxybenzoate
  • Isobutyl salicylate
  • 2-Isobutoxycarbonylphenol

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