MedKoo Cat#: 145738 | Name: Nerylacetone

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Nerylacetone is a terpene compound. It serves as an intermediate in the synthesis of cis-Nerolidol, a major component of essential oils from Thymus ciliatus. In pharmacological studies, nerylacetone has demonstrated significant effects on cardiac muscle contractility in guinea pig left atrium preparations. Additionally, it has been identified as a potential and effective treatment for malaria.

Chemical Structure

Nerylacetone
Nerylacetone
CAS#3879-26-3

Theoretical Analysis

MedKoo Cat#: 145738

Name: Nerylacetone

CAS#: 3879-26-3

Chemical Formula: C13H22O

Exact Mass: 194.1700

Molecular Weight: 194.32

Elemental Analysis: C, 80.35; H, 11.41; O, 8.23

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
Nerylacetone;
IUPAC/Chemical Name
(Z)-6,10-dimethylundeca-5,9-dien-2-one
InChi Key
HNZUNIKWNYHEJJ-XFXZXTDPSA-N
InChi Code
1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9-
SMILES Code
CC(=O)CC\C=C(\C)CCC=C(C)C
Appearance
To be determined
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 -4 C for short term (days to weeks) or -20 C for long term(months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 194.32 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Wróblewska-Kurdyk A, Dancewicz K, Gliszczyńska A, Gabryś B. Antifeedant Potential of Geranylacetone and Nerylacetone and Their Epoxy-Derivatives against Myzus persicae (Sulz.). Molecules. 2022 Dec 13;27(24):8871. doi: 10.3390/molecules27248871. PMID: 36558003; PMCID: PMC9784399. 2: Gliszczyńska A, Switalska M, Wietrzyk J, Wawrzeńczyk C. Synthesis of a natural gamma-butyrolactone from nerylacetone by Acremonium roseum and Fusarium oxysporum cultures. Nat Prod Commun. 2011 Mar;6(3):367-70. PMID: 21485276. 3: Camargo KC, Duarte LP, Vidal DM, Pereira HV, Pereira RCG, de Aguilar MG, de Sousa GF, Filho SAV, Mercadante-Simões MO, Messias MCTB, de Oliveira DM. Chemodiversity of Essential Oils from Nine Species of Celastraceae. Chem Biodivers. 2020 May;17(5):e2000107. doi: 10.1002/cbdv.202000107. Epub 2020 May 4. PMID: 32222029. 4: Bogazkaya AM, von Bühler CJ, Kriening S, Busch A, Seifert A, Pleiss J, Laschat S, Urlacher VB. Selective allylic hydroxylation of acyclic terpenoids by CYP154E1 from Thermobifida fusca YX. Beilstein J Org Chem. 2014 Jun 13;10:1347-1353. doi: 10.3762/bjoc.10.137. PMID: 24991288; PMCID: PMC4077532. 5: Luo H, Tang XA, Deng Y, Deng Z, Liu M. The extraction and identification of active components of the sex pheromones of Asian citrus psyllid, Diaphorina citri. Pestic Biochem Physiol. 2023 May;192:105421. doi: 10.1016/j.pestbp.2023.105421. Epub 2023 Apr 6. PMID: 37105641. 6: Yu JS, Kleckley TS, Wiemer DF. Synthesis of farnesol isomers via a modified Wittig procedure. Org Lett. 2005 Oct 27;7(22):4803-6. doi: 10.1021/ol0513239. PMID: 16235893. 7: Hoshino T, Kobayashi N, Ishibashi E, Hashimoto S. Inhibitory activity of 8-azadecalin derivatives towards 2,3-oxidosqualene:lanosterol cyclases from baker's yeast and pig's liver. Biosci Biotechnol Biochem. 1995 Apr;59(4):602-9. doi: 10.1271/bbb.59.602. PMID: 7772824. 8: Seifert A, Vomund S, Grohmann K, Kriening S, Urlacher VB, Laschat S, Pleiss J. Rational design of a minimal and highly enriched CYP102A1 mutant library with improved regio-, stereo- and chemoselectivity. Chembiochem. 2009 Mar 23;10(5):853-61. doi: 10.1002/cbic.200800799. Erratum in: Chembiochem. 2009 Jun 15;10(9):1426. PMID: 19222039. 9: Li Y, Li J, Fan L. Effects of combined drying methods on physicochemical and rheological properties of instant Tremella fuciformis soup. Food Chem. 2022 Dec 1;396:133644. doi: 10.1016/j.foodchem.2022.133644. Epub 2022 Jul 8. PMID: 35870245.