2,3-Dimethylcyclohexanol

Base Information

• Chemical Name: 2,3-Dimethylcyclohexanol
• CAS No.: 1502-24-5
• Molecular Formula: C8H16O
• Molecular Weight: 128.214
• Hs Code.: 2906120090
• European Community (EC) Number: 216-121-9
• DSSTox Substance ID: DTXSID10933890
• Nikkaji Number: J206.707B
• Mol file: 1502-24-5.mol

Synonyms:2,3-Dimethylcyclohexanol;1502-24-5;2,3-Dimethylcyclohexan-1-ol;Cyclohexanol, 2,3-dimethyl-;EINECS 216-121-9;SCHEMBL441761;DTXSID10933890;BAA50224;BCP30898;MFCD00001444;AKOS009158111;DS-9504;SB83878;CS-0196810;D1660;EN300-83988;C72857;A884185

Chemical Property of 2,3-Dimethylcyclohexanol

Chemical Property:

• Appearance/Colour: Clear colourless liquid
• Vapor Pressure: 0.236mmHg at 25°C
• Refractive Index: n20/D 1.465(lit.)
• Boiling Point: 182.4 °C at 760 mmHg
• Flash Point: 65.6 °C
• PSA: 20.23000
• Density: 0.893 g/cm³
• LogP: 1.80340
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 128.120115130
• Heavy Atom Count: 9
• Complexity: 90.6

Purity/Quality:

97% ^*data from raw suppliers

2,3-Dimethylcyclohexanol ^*data from reagent suppliers

Safty Information:

• Safety Statements: S24/25:Avoid contact with skin and eyes.

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCCC(C1C)O

Technology Process of 2,3-Dimethylcyclohexanol

There total 58 articles about 2,3-Dimethylcyclohexanol 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: 93.0%

2,3-Dimethylphenol (526-75-0) → 2,3-dimethylcyclohexan-1-ol (1502-24-5)

Guidance literature:

With hydrogen; nickel; In hexane; at 140 ℃; for 3h;

Reference yield: 75.0%

cis-1,2-dimethylcyclohexane (2207-01-4) → 2,3-dimethylcyclohexan-1-ol (1502-24-5) + cis-1,2-dimethylcyclohexanol (19879-12-0)

Guidance literature:

With ammonium cerium (IV) nitrate; [PPh₄]₂[Mn^V(N)(CN)₄]; acetic acid; In 2,2,2-trifluoroethanol; water; at 23 ℃; for 0.5h; Inert atmosphere;

DOI:10.1021/ja5019546

Reference yield: 74.0%

cis-1,2-dimethylcyclohexane (2207-01-4) → 3,4-dimethylcyclohexanol (5715-23-1) + 2,3-dimethylcyclohexan-1-ol (1502-24-5) + cis-1,2-dimethylcyclohexanol (19879-12-0)

Guidance literature:

With 3-chloro-benzenecarboperoxoic acid; (5,10,15,20-tetrakis(pentafluorophenyl)porphyrinato)iron(III) chloride; In dichloromethane; acetonitrile; for 1h; Product distribution; Ambient temperature; other catalysts;

DOI:10.1246/bcsj.72.707

upstream raw materials:

2,3-Dimethylphenol

cis-1,2-dimethylcyclohexane

1,2-trans-dimethylcyclohexane

1,2-Dimethyl-cyclohexane

Downstream raw materials:

2,3-dimethylcyclohexanone

cis-2,3-dimethylcyclohexanone

trans-2,3-dimethylcyclohexanone

2-chloro-2,3-dimethyl-cyclohexanone