Isoamyl salicylate

CAS Registry Number®

87-20-7

CAS Name

Isoamyl salicylate

Molecular Formula

C12H16O3

Molecular Mass

208.25

Cite this Page

Isoamyl salicylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=87-20-7 (retrieved 2024-11-22) (CAS RN: 87-20-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    278 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C12H16O3/c1-9(2)7-8-15-12(14)10-5-3-4-6-11(10)13/h3-6,9,13H,7-8H2,1-2H3

InChIKey

InChIKey=PMGCQNGBLMMXEW-UHFFFAOYSA-N

SMILES

C(OCCC(C)C)(=O)C1=C(O)C=CC=C1

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 2-hydroxy-, 3-methylbutyl ester
  • Salicylic acid, isopentyl ester
  • Isopentyl alcohol, salicylate
  • Isoamyl o-hydroxybenzoate
  • Isopentyl salicylate

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Deleted or Replaced CAS Registry Numbers

34377-38-3

CAS INSIGHTSTM
Targeted protein degrader structure, illustration