2-(2-Chloropropan-2-yl)-5-methylcyclohexan-1-one

Base Information

Chemical Name:2-(2-Chloropropan-2-yl)-5-methylcyclohexan-1-one
CAS No.:66448-75-7
Molecular Formula:C₁₀H₁₇ClO
Molecular Weight:188.697
Hs Code.:
DSSTox Substance ID:DTXSID90574280

Synonyms:66448-75-7;2-(2-Chloropropan-2-yl)-5-methylcyclohexan-1-one;SCHEMBL11033610;DTXSID90574280

Suppliers and Price of 2-(2-Chloropropan-2-yl)-5-methylcyclohexan-1-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 1 raw suppliers

Chemical Property of 2-(2-Chloropropan-2-yl)-5-methylcyclohexan-1-one

Chemical Property:

PSA：17.07000
LogP:3.00910
XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:188.0967929
Heavy Atom Count:12
Complexity:186

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1CCC(C(=O)C1)C(C)(C)Cl

Technology Process of 2-(2-Chloropropan-2-yl)-5-methylcyclohexan-1-one

There total 4 articles about 2-(2-Chloropropan-2-yl)-5-methylcyclohexan-1-one 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:

: 89-82-7,90449-51-7
pulegone

: 66448-75-7,125225-97-0,125226-00-8
(5R)-2-(1-Chloro-1-methylethyl)-5-methylcyclohexanone

Guidance literature:: With hydrogenchloride; at 0 ℃; for 24h;
DOI:10.1021/jo00294a054

Reference yield:

: 86613-13-0,125225-99-2,125353-54-0
(5R)-2-(1-Bromo-1-methylethyl)-5-methylcyclohexanone

: 66448-75-7,125225-97-0,125226-00-8
(5R)-2-(1-Chloro-1-methylethyl)-5-methylcyclohexanone

Guidance literature:: Multi-step reaction with 2 steps

1: tetrahydrofuran; pentane / -78 °C

2: HCl gas / 24 h / 0 °C

With hydrogenchloride; In tetrahydrofuran; pentane;
DOI:10.1021/jo00294a054