2,4-Diacetyl-3-(4-chlorophenyl)-5-hydroxy-5-methylcyclohexanone

Base Information

Chemical Name:2,4-Diacetyl-3-(4-chlorophenyl)-5-hydroxy-5-methylcyclohexanone
CAS No.:71954-37-5
Molecular Formula:C17H19ClO4
Molecular Weight:322.788
Hs Code.:
DSSTox Substance ID:DTXSID80386672
Nikkaji Number:J2.700.774K

Synonyms:2,4-diacetyl-3-(4-chlorophenyl)-5-hydroxy-5-methylcyclohexanone;71954-37-5;DTXSID80386672;2,4-Diacetyl-3-(4-chloro-phenyl)-5-hydroxy-5-methyl-cyclohexanone;STL328524;AKOS000564640;AKOS022003294;NCGC00335811-01;EU-0014462;AB00097083-01;AB00097083-04

Suppliers and Price of 2,4-Diacetyl-3-(4-chlorophenyl)-5-hydroxy-5-methylcyclohexanone

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
Packaging
price

Total 1 raw suppliers

Chemical Property of 2,4-Diacetyl-3-(4-chlorophenyl)-5-hydroxy-5-methylcyclohexanone

Chemical Property:

PSA：71.44000
LogP:2.55780
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:322.0971868
Heavy Atom Count:22
Complexity:481

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)C1C(C(C(CC1=O)(C)O)C(=O)C)C2=CC=C(C=C2)Cl

Technology Process of 2,4-Diacetyl-3-(4-chlorophenyl)-5-hydroxy-5-methylcyclohexanone

There total 1 articles about 2,4-Diacetyl-3-(4-chlorophenyl)-5-hydroxy-5-methylcyclohexanone 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%

: 104-88-1
4-chlorobenzaldehyde

: 123-54-6,81235-32-7
acetylacetone

: 71954-37-5
2,4-Diacetyl-3-(4-chlorophenyl)-5-hydroxy-5-methylcyclohexanone

Guidance literature:: With piperidine; In ethanol; for 0.0166667h; microwave irradiation;

Reference yield: 95.0%

: 71954-37-5
2,4-Diacetyl-3-(4-chlorophenyl)-5-hydroxy-5-methylcyclohexanone

: 105807-59-8
5-Acetyl-4-(4-chlorophenyl)-6-hydroxy-3,6-dimethyl-4,5,6,7-tetrahydro-2,1-benzisoxazole

Guidance literature:: With hydroxylamine hydrochloride; In ethanol; for 0.0166667h; microwave irradiation;

Reference yield:

: 7357-70-2
Cyanothioacetamide

: 71954-37-5
2,4-Diacetyl-3-(4-chlorophenyl)-5-hydroxy-5-methylcyclohexanone

: C₂₀H₁₈ClN₂O₂S^(1-)*Na⁽¹⁺⁾

Guidance literature:: With sodium methylate; Yield given. Multistep reaction; 1) ethanol, heating to 75 deg C; 2) ethanol;
DOI:10.1007/BF01169354