4-Acetyl-4-propylcyclohexan-1-one

Base Information

Chemical Name:4-Acetyl-4-propylcyclohexan-1-one
CAS No.:76921-64-7
Molecular Formula:C11H18O2
Molecular Weight:182.263
Hs Code.:
DSSTox Substance ID:DTXSID00505969
Wikidata:Q82361459

Synonyms:4-Acetyl-4-propylcyclohexan-1-one;76921-64-7;SCHEMBL10783838;4-acetyl-4-n-propylcyclohexanone;DTXSID00505969;JPCWHJLFXWFUSL-UHFFFAOYSA-N

Suppliers and Price of 4-Acetyl-4-propylcyclohexan-1-one

Supply Marketing:

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

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Chemical Property of 4-Acetyl-4-propylcyclohexan-1-one

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:182.130679813
Heavy Atom Count:13
Complexity:208

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCC1(CCC(=O)CC1)C(=O)C

Technology Process of 4-Acetyl-4-propylcyclohexan-1-one

There total 3 articles about 4-Acetyl-4-propylcyclohexan-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: 62.0%

: 76921-69-2
3-acetyl-3-propylpentane-1,5-dicarboxylic acid

: 76921-64-7
4-acetyl-4-propylcyclohexanone

Guidance literature:: With acetic anhydride; for 14h; Heating;
DOI:10.1039/P29810000026

Reference yield:

: 591-78-6
n-hexan-2-one

: 76921-64-7
4-acetyl-4-propylcyclohexanone

Guidance literature:: Multi-step reaction with 3 steps

1: 48 percent / benzyltrimethylammonium hydroxide / methanol; 2-methyl-propan-2-ol / 10 - 20 °C

2: 92 percent / sodium hydroxide, water / 10 h / Heating

3: 62 percent / acetic anhydride / 14 h / Heating

With sodium hydroxide; water; acetic anhydride; N-benzyl-trimethylammonium hydroxide; In methanol; tert-butyl alcohol;
DOI:10.1039/P29810000026

Reference yield:

: 76921-73-8
3-methyl-1,5-dicyano-3-propylpentane

: 76921-64-7
4-acetyl-4-propylcyclohexanone

Guidance literature:: Multi-step reaction with 2 steps

1: 92 percent / sodium hydroxide, water / 10 h / Heating

2: 62 percent / acetic anhydride / 14 h / Heating

With sodium hydroxide; water; acetic anhydride;
DOI:10.1039/P29810000026