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(-)-TRANS-MYRTANOL, a monoterpenol chemical compound, is a colorless liquid with a fresh, woody, and slightly sweet aroma. It is derived from natural sources such as myrtle and is known for its antimicrobial, anti-inflammatory properties, and its use in perfumery and fragrance industry as a scent ingredient. Furthermore, it is utilized in aromatherapy for its relaxing and calming effects on the mind and body, and has potential therapeutic effects in the treatment of various diseases, making it a subject of interest in medicinal chemistry research.

53369-17-8

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53369-17-8 Usage

Uses

Used in Perfumery and Fragrance Industry:
(-)-TRANS-MYRTANOL is used as a scent ingredient for its fresh, woody, and slightly sweet aroma, adding a pleasant fragrance to various products.
Used in Aromatherapy:
(-)-TRANS-MYRTANOL is used as a therapeutic agent for its relaxing and calming effects on the mind and body, helping to alleviate stress and promote a sense of well-being.
Used in Medicinal Chemistry Research:
(-)-TRANS-MYRTANOL is used as a subject of study for its potential therapeutic effects in the treatment of various diseases, due to its antimicrobial and anti-inflammatory properties.

Check Digit Verification of cas no

The CAS Registry Mumber 53369-17-8 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,3,3,6 and 9 respectively; the second part has 2 digits, 1 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 53369-17:
(7*5)+(6*3)+(5*3)+(4*6)+(3*9)+(2*1)+(1*7)=128
128 % 10 = 8
So 53369-17-8 is a valid CAS Registry Number.
InChI:InChI=1/C10H18O/c1-10(2)8-4-3-7(6-11)9(10)5-8/h7-9,11H,3-6H2,1-2H3/t7-,8+,9+/m1/s1

53369-17-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name [(1S,4S,5S)-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]methanol

1.2 Other means of identification

Product number -
Other names -

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:53369-17-8 SDS

53369-17-8Relevant academic research and scientific papers

New hybrids derived from the natural compound (-)-β-pinene and amides or acylthioureas as antitumor agents

Liao, Shengliang,Rao, Xiaoping,Shen, Minggui,Si, Hongyan,Song, Jie,Shang, Shibin,Song, Zhanqian

, p. 271 - 284 (2020/04/17)

Background: Plant-derived natural compounds have a unique molecular structure and rich biological activity, hence, they are treated as important raw materials for the development of drugs. Methods: A natural compound (-)-β-pinene was used as a raw material, and twenty-six novel derivatives with amide or acylthiourea groups were synthesized based on the molecular hybridization method. In vitro antitumor activity of these derivatives on human breast cancer cell line MCF7 and human colon cancer cell line SW1116 were tested by MTT method. The effects of the synthesized derivatives on the morphology of MCF7 and SW1116 were observed by fluorescent inverted microscope. Results: The preliminary structure-activity relationship analysis demonstrates that the position and species of substituents on the aromatic ring of derivatives have an effect on the antitumor activity of derivatives. Observation of the cell morphology reveals that derivatives with antitumor activity can lead to rounding of the cell morphology, a decrease in cell volume and cell density, and ultimately inhibition of the proliferation of MCF7 and SW1116 cells. The antitumor activity evaluation results show that among these derivatives, compounds 5c, 5e, 5h, 7c, 7b and 7e exhibit good antitumor activity against MCF7, and compounds 5c, 5e, 5h and 7j exert moderate antitumor activity against SW1116. Conclusion: This study hopes to promote the high value-added utilization of natural compounds β-pinene and the development of novel antitumor drugs.

A General Regioselective Synthesis of Alcohols by Cobalt-Catalyzed Hydrogenation of Epoxides

Beller, Matthias,Junge, Kathrin,Leischner, Thomas,Li, Wu,Liu, Weiping

supporting information, p. 11321 - 11324 (2020/05/16)

A straightforward methodology for the synthesis of anti-Markovnikov-type alcohols is presented. By using a specific cobalt triphos complex in the presence of Zn(OTf)2 as an additive, the hydrogenation of epoxides proceeds with high yields and selectivities. The described protocol shows a broad substrate scope, including multi-substituted internal and terminal epoxides, as well as a good functional-group tolerance. Various natural-product derivatives, including steroids, terpenoids, and sesquiterpenoids, gave access to the corresponding alcohols in moderate-to-excellent yields.

Visible-Light-Mediated Aerobic Oxidation of Organoboron Compounds Using in Situ Generated Hydrogen Peroxide

Weng, Wei-Zhi,Liang, Hao,Zhang, Bo

, p. 4979 - 4983 (2018/08/24)

A simple and general visible-light-mediated oxidation of organoboron compounds has been developed with rose bengal as the photocatalyst, substoichiometric Et3N as the electron donor, as well as air as the oxidant. This mild and metal-free protocol shows a broad substrate scope and provides a wide range of aliphatic alcohols and phenols in moderate to excellent yields. Notably, the robustness of this method is demonstrated on the stereospecific aerobic oxidation of organoboron compounds.

OPEN-FLASK HYDROBORATION AND THE USE THEREOF

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Paragraph 0046; 0058; 0059, (2018/03/25)

The present disclosure generally relates to a process for hydroboration of an alkene or alkyne using ammonia borane (AB). In particular, the present invention relates to hydroboration of an alkene or alkyne in the presence of air or moisture, and a clean process for facile preparation of an alcohol by oxidizing the organoborane so formed with hydrogen peroxide. The products, including aminodialkylboranes, ammonia trialkylborane complexes, as well as various alcohols so prepared, are within the scope of this disclosure.

Comparison of enzymatic and acid hydrolysis of bound flavor compounds in model system and grapes

Dziadas, Mariusz,Jeleń, Henryk H.

, p. 412 - 418 (2015/06/17)

Four synthesized terpenyl-β-D-glycopyranosides (geranyl, neryl, citronellyl, myrtenyl) were subjected to enzymatic (AR 2000, pH 5.5) and acid (citric buffer, pH 2.5) hydrolysis. Decrease of glycosides was measured by HPLC and the volatiles released - by comprehensive gas chromatography-mass spectrometry (GC x GC-ToF-MS). Enzymatic hydrolysis performed for 21 h yielded 100% degree of hydrolysis for all glycosides but citronellyl (97%). Degree of acid hydrolysis was highly dependent on type of aglycone and the conditions. The highest degree was achieved for geraniol, followed by citronellol and nerol. Myrtenylo-β-D-glycopyranoside was the most resistant glycoside to hydrolysis. Acid hydrolysis degree was also related to temperature/time combination, the highest being for 100 °C and 2 h. In a result of enzymatic hydrolysis 85-91% of total peak areas was terpene aglycone, whereas for acid hydrolysis the area of released terpene aglycone did not exceed 1.3% of total peak area indicating almost complete decomposition/transformation of terpenyl aglycone.

Development of a flow method for the hydroboration/oxidation of olefins

Souto, José A.,Stockman, Robert A.,Ley, Steven V.

, p. 3871 - 3877 (2015/03/30)

A method for the continuous preparation of alcohols by hydroboration/oxidation of olefins using flow techniques is described. The process allows the isolation of up to 120 mmol h-1 of the desired alcohol in a very rapid manner with good functional group tolerance. The flow setup can be modified to perform a continuous extraction of the desired alcohol from the biphasic mixture produced by the reaction. This journal is

Synthesis and structure of some cis-and trans-myrtanylstannanes

Beckmann, Jens,Duthie, Andrew,Grassmann, Marian

experimental part, p. 161 - 166 (2009/03/12)

Enantiomerically pure cis- and trans-myrtanylstannanes cis-MyrSnPh3 (1), trans-MyrSnPh3 (2), cis-MyrSnPh2Cl (3), trans-MyrSnPh2Cl (4), cis-MyrSnPhCl2 (5), trans-MyrSnPhCl2 (6), cis-MyrSnCl

New effective reagent [Cp2ZrH2 · ClAlEt2]2 for alkene hydrometallation

Parfenova, Lyudmila V.,Vil'danova, Rushana F.,Pechatkina, Svetlana V.,Khalilov, Leonard M.,Dzhemilev, Usein M.

, p. 3424 - 3429 (2008/02/12)

New bimetallic complex [Cp2ZrH2 · ClAlEt2]2 (1) was synthesized, and its reactivity in hydrometallation reaction with the following alkenes was studied: hept-1-ene, okt-1-ene, α-methylstyrene, (1S)-β-pinene, (+)-camphene. Complex 1 shows the highest reactivity among the other known Al,Zr-bimetallic complexes: [Cp2ZrH2 · ClAlBui2]2 (2), [Cp2ZrH2 · AlEt3]2 (3), [Cp2ZrH2 · AlBui3]2 (4) and [Cp2ZrH2 · HAlBui2] (5) as well as organoaluminium compounds (OAC): iBu2AlH, iBu3Al and iBu2AlCl in presence of Zr catalysts. Chlorine containing complexes 1 and 2 appear to be more effective in alkene hydrometallation, and relative hydrometallation rates are (1S)-β-pinene ≤ (+)-camphene 2 run with high diastereoselectivity and yield trans-myrtanol. However, the diastereoselectivity of (+)-camphene hydrometallation is less than that for (1S)-β-pinene, and the reaction gives predominately endo-camphanol.

PS-COD and PS-9-BBN: Polymer-supported reagents for solution-phase parallel synthesis

Revell, Jefferson D.,Doerner, Barbara,White, Peter D.,Ganesan

, p. 831 - 833 (2007/10/03)

(Chemical Equation Presented) 1,5-Cyclooctadiene was deprotonated under LICKOR conditions and reacted with Merrifield resin to afford an immobilized cyclooctadiene in high yield. This polymer is effective as a halogen scavenger, while hydroboration leads to a supported 9-BBN analogue. The latter exhibits similar regioselectivity to 9-BBN in olefin hydroboration.

HYDRONOPOL DERIVATIVES AS AGONISTS ON HUMAN ORL1 RECEPTORS

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Page/Page column 6, (2010/02/13)

The invention relates to a group of hydronopol derivatives which are agonists on human ORL1 (nociceptin) receptors. The invention also relates to the preparation of these compounds, to pharmaceutical compositions containing a pharmacologically active amount of at least one of these novel hydronopol derivatives as an active ingredient, as well as to the use of these pharmaceutical compositions for the treatment of disorders in which ORL1 receptors are involved. The invention relates to compounds of the general formula (1) wherein the symbols have the meanings as given in the description.

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