Myrcenol

Base Information

• Chemical Name: Myrcenol
• CAS No.: 543-39-5
• Molecular Formula: C10H18 O
• Molecular Weight: 154.252
• Hs Code.: 2905290000
• European Community (EC) Number: 208-843-8
• UNII: X4XS5MYJ20
• DSSTox Substance ID: DTXSID5027192
• Nikkaji Number: J13.753G
• Wikipedia: Myrcenol
• Wikidata: Q411500
• Metabolomics Workbench ID: 47196
• Mol file: 543-39-5.mol

Synonyms:2-methyl-6-methyleneoct-7-en-2-ol;3-methylene-7-methyl-1-octen-7-ol;7-hydroxy-7-methyl-3-methylene-1-octene;7-methyl-3-methylene-1-octen-7-ol;myrcenol

Chemical Property of Myrcenol

Chemical Property:

• Vapor Pressure: 0.0182mmHg at 25°C
• Refractive Index: 1.4666 (estimate)
• Boiling Point: 224.5°Cat760mmHg
• PKA: 15.30±0.29(Predicted)
• Flash Point: 84.8°C
• PSA: 20.23000
• Density: 0.851g/cm³
• LogP: 2.66980
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 154.135765193
• Heavy Atom Count: 11
• Complexity: 145

Purity/Quality:

99.50% ^*data from raw suppliers

2H MYRCENOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(CCCC(=C)C=C)O

Technology Process of Myrcenol

There total 19 articles about Myrcenol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 28.2%

→ myrcenol (543-39-5)

Guidance literature:

Reference yield:

→ myrcenol (543-39-5)

Guidance literature:

With sodium hydroxide;

DOI:10.1021/ja01271a046 DOI:10.1021/ja01526a061

Reference yield:

(E)-N,N-diethyl-3,7-dimethyl-2,6-octadienylamine (40267-53-6) → myrcenol (543-39-5)

Guidance literature:

Multi-step reaction with 2 steps

1: 92 percent / 50percent sulfuric acid / H₂O / 1 h / 0 °C

2: 93.5 percent Chromat. / 3-C3H5)Ph2p(CH2)5PPh2>(+)ClO4(-) / 3 h / 130 °C / 20 Torr / other catalysts

With sulfuric acid; 3-C3H5)Ph2P(CH2)5PPh2>(+)ClO4(-); In water;

DOI:10.1246/cl.1986.157

upstream raw materials:

2-(4-chloro-4-methyl-pentyl)-buta-1,3-diene

methyl magnesium iodide

ethyl 5-methylene-6-heptenoate

Geraniol

Downstream raw materials:

2-methyl-6-methylideneoct-7-en-2-yl acetate

dihydrolyral

4-(4-hydroxy-4-methylpentyl)cyclohex-3-enecarbaldehyde

1-(8,8-dimethyl-1,2,3,4,6,7,8,8a-octahydro-[2]naphthyl)-ethanone

Refernces

• 1、 Nelson. "". . p. 920. Retrieved 1938.
• 2、 Morin, Ph.,Gunther, C.,Peyron, L.,Richard, H.. "Etude des phenomenes physico-chimiques intervenant lors du procede d'hydrodistillation". . p. 921 - 930. Retrieved 2007/10/02.