3-Methyl-1-(prop-2-en-1-yl)cyclohexan-1-ol

Base Information

• Chemical Name: 3-Methyl-1-(prop-2-en-1-yl)cyclohexan-1-ol
• CAS No.: 24580-57-2
• Molecular Formula: C10H18O
• Molecular Weight: 154.252
• DSSTox Substance ID: DTXSID70540766
• Nikkaji Number: J1.034.025J
• Mol file: 24580-57-2.mol

Synonyms:24580-57-2;3-Methyl-1-(prop-2-en-1-yl)cyclohexan-1-ol;DTXSID70540766;1-Allyl-3-methylcyclohexan-1-ol;AKOS018291059;CS-0353426;EN300-393696

Chemical Property of 3-Methyl-1-(prop-2-en-1-yl)cyclohexan-1-ol

Chemical Property:

• Boiling Point: 206-209 °C
• PSA: 20.23000
• Density: 0.92244 g/cm3(Temp: 0 °C)
• LogP: 2.50370
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 154.135765193
• Heavy Atom Count: 11
• Complexity: 142

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCCC(C1)(CC=C)O

Technology Process of 3-Methyl-1-(prop-2-en-1-yl)cyclohexan-1-ol

There total 6 articles about 3-Methyl-1-(prop-2-en-1-yl)cyclohexan-1-ol 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: 95.0%

allylmagnesium bromide (1730-25-2) + 3-Methylcyclohexanone (591-24-2,625-96-7) → 1-allyl-3-methylcyclohexanol (24580-57-2)

Guidance literature:

With bis(2,6-di-tert-butyl-4-methylphenoxide)methylaluminum; In diethyl ether; toluene; at -78 ℃; for 2h;

DOI:10.1021/ja00301a048

Reference yield: 91.0%

allyl bromide (106-95-6) + 3-Methylcyclohexanone (591-24-2,625-96-7) → 1-allyl-3-methylcyclohexanol (24580-57-2)

Guidance literature:

With indium; allyl β-D-fructopyranoside; In water; at 20 ℃; for 6h; stereoselective reaction;

DOI:10.1016/j.tetlet.2010.07.028

Reference yield:

3-Methylcyclohexanone (591-24-2,625-96-7) → 1-allyl-3-methylcyclohexanol (24580-57-2)

Guidance literature:

With boron trifluoride diethyl etherate; sodium iodide; Yield given. Multistep reaction; 1) Et₂O, r. t., 12 h, 2) moist acetone;

DOI:10.1016/S0040-4039(00)92269-X

upstream raw materials:

allyl iodid

3-Methylcyclohexanone

allylmagnesium bromide

allyl bromide

Downstream raw materials:

(1-hydroxy-3-methyl-cyclohexyl)-acetic acid

oxalic acid