Isoamyl salicylate

• CAT Number: I029541
• CAS Number: 87-20-7
• Molecular Formula: C12H16O3
• Molecular Weight: 208.26
• Purity: 98%
• Synonyms: Isoamyl salicylate; NSC 7952; NSC-7952; NSC7952
• Solubility: Soluble in DMSO
• Appearance: Solid powder
• Storage: 2-8°C
• IUPAC Name: Benzoic acid, 2-hydroxy-, 3-methylbutyl ester
• 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: PMGCQNGBLMMXEW-UHFFFAOYSA-N
• SMILES: O=C(OCCC(C)C)C1=CC=CC=C1O

Isoamyl salicylate（Cat No.:I029541） is a compound that can be found in alcoholic beverages and is commonly isolated from various fruit aromas. It contributes to the fruity and sweet scent in these beverages and is often used as a flavoring agent. With its pleasant aroma, isoamyl salicylate enhances the sensory experience and adds a fruity note to drinks. It is commonly utilized in the production of flavored spirits, liqueurs, and alcoholic beverages to impart a fruity character and enhance the overall sensory appeal.

Reference

1: Chemsa AE, Zellagui A, Öztürk M, Erol E, Ceylan O, Duru ME, Lahouel M. Chemical composition, antioxidant, anticholinesterase, antimicrobial and antibiofilm activities of essential oil and methanolic extract of Anthemis stiparum subsp. sabulicola (Pomel) Oberpr. Microb Pathog. 2018 Jun;119:233-240. doi: 10.1016/j.micpath.2018.04.033. Epub 2018 Apr 21. PubMed PMID: 29684540.
2: Api AM, Belsito D, Bhatia S, Bruze M, Calow P, Dagli ML, Dekant W, Fryer AD, Kromidas L, La Cava S, Lalko JF, Lapczynski A, Liebler DC, Miyachi Y, Politano VT, Ritacco G, Salvito D, Schultz TW, Shen J, Sipes IG, Wall B, Wilcox DK. RIFM fragrance ingredient safety assessment, isoamyl salicylate, CAS registry number 87-20-7. Food Chem Toxicol. 2015 Oct;84 Suppl:S110-21. doi: 10.1016/j.fct.2015.09.014. Epub 2015 Sep 28. Review. PubMed PMID: 26419451.
3: de Nicolaï P. A smelling trip into the past: the influence of synthetic materials on the history of perfumery. Chem Biodivers. 2008 Jun;5(6):1137-46. doi: 10.1002/cbdv.200890090. PubMed PMID: 18618400.
4: Jiang T, Zhao Q, Li M, Yin H. Preparation of mesoporous titania solid superacid and its catalytic property. J Hazard Mater. 2008 Nov 30;159(2-3):204-9. doi: 10.1016/j.jhazmat.2008.02.008. Epub 2008 Feb 12. PubMed PMID: 18343571.
5: Lapczynski A, Jones L, McGinty D, Bhatia S, Letizia CS, Api AM. Fragrance material review on isoamyl salicylate. Food Chem Toxicol. 2007;45 Suppl 1:S418-23. Epub 2007 Sep 14. Review. PubMed PMID: 18031914.
6: Novikov SM, Melńikova NN, Neriueva VV, Semenovykh LN, Murkova MV. [Hygienic standardization of methyl salicylate and isoamyl salicylate in the atmospheric air of populated areas]. Gig Sanit. 1994 Jan;(1):4-5. Russian. PubMed PMID: 8168708.
7: Novikov SM, Mel’nikova NN, Andrusov VE, Semenovykh LN, Murkova MV. [Study of toxicokinetics and cumulative properties of salicylic acid derivatives]. Gig Sanit. 1992 Jul-Aug;(7-8):65-8. Russian. PubMed PMID: 1468676.
8: Yamada S, Cao J, Sumita O, Kurasawa K, Kurata H, Oh K, Matsuoka H. Automatic antifungal activity analyzing system on the basis of dynamic growth process of a single hypha. Mycopathologia. 1992 May;118(2):65-9. PubMed PMID: 1435944.
9: Matsuoka H, Ii Y, Takekawa Y, Teraoka T. Evaluation of antifungal volatile compounds on the basis of the elongation rate of a single hypha. Appl Environ Microbiol. 1990 Dec;56(12):3779-84. PubMed PMID: 2082824; PubMed Central PMCID: PMC185067.
10: Drake JJ, Guant IF, Butterworth KR, Hoosen J, Hardy J, Gangolli SD. Short-term toxicity of isoamyl salicylate in rats. Food Cosmet Toxicol. 1975 Apr;13(2):185-93. PubMed PMID: 1132848.