1-Methyl-4-oxo-cyclohexanecarboxylic acid

Base Information

• Chemical Name: 1-Methyl-4-oxo-cyclohexanecarboxylic acid
• CAS No.: 24463-41-0
• Molecular Formula: C8H12O3
• Molecular Weight: 156.181
• Hs Code.: 2918300090
• Mol file: 24463-41-0.mol

Synonyms:1-Oxo-4-methyl-4-cyclohexancarbonsaeure;1-methyl-4-oxo-cyclohexanecarboxylic acid;methyl 4-oxocyclohexanecarboxylic acid;1-Methyl-4-oxocyclohexancarbonsaeure;Cyclohexanecarboxylic acid, 1-methyl-4-oxo-;1-methyl-4-oxo-1-cyclohexanecarboxylic acid;

Chemical Property of 1-Methyl-4-oxo-cyclohexanecarboxylic acid

Chemical Property:

• Melting Point: 78-79 °C
• Boiling Point: 130-135 °C(Press: 0.5 Torr)
• PKA: 4.57±0.20(Predicted)
• PSA: 54.37000
• Density: 1.168±0.06 g/cm3(Predicted)
• LogP: 1.22040
• Storage Temp.: Sealed in dry,Room Temperature

Purity/Quality:

97% ^*data from raw suppliers

1-methyl-4-oxocyclohexanecarboxylicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 1-Methyl-4-oxo-cyclohexanecarboxylic acid

There total 12 articles about 1-Methyl-4-oxo-cyclohexanecarboxylic acid 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: 100.0%

8-methyl-1,4-dioxaspiro[4.5]decane-8-carboxylic acid (412293-42-6) → 1-methyl-4-oxo-cyclohexanecarboxylic acid (24463-41-0)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; water; at 65 ℃; for 3h;

Reference yield: 83.0%

ethyl 1-methyl-4-oxo-1-cyclohexanecarboxylate (147905-77-9) → 1-methyl-4-oxo-cyclohexanecarboxylic acid (24463-41-0)

Guidance literature:

With lithium hydroxide; In tetrahydrofuran; methanol; water; at 20 ℃; for 18h;

DOI:10.1021/acs.jmedchem.6b01584

Reference yield:

→ 1-methyl-4-oxo-cyclohexanecarboxylic acid (24463-41-0)

Guidance literature:

With acetic anhydride; Erhitzen des Reaktionsprodukts unter 30 Torr bis auf 220grad;

DOI:10.1021/ja01206a056

upstream raw materials:

methyl 1-methyl-4-oxo-1-cyclohexanecarboxylate

4-[1,3]dioxolan-2-yl-4-methyl-cyclohexanol

4-methoxy-1-methyl-cyclohex-3-enecarboxylic acid methyl ester

ethyl 1-methyl-4-oxo-1-cyclohexanecarboxylate

Downstream raw materials:

methyl 1-methyl-4-oxo-1-cyclohexanecarboxylate

1-(4-methoxy-phenyl)-4-methyl-2-oxa-bicyclo[2.2.2]octan-3-one

4-(4-methoxy-phenyl)-1-methyl-cyclohex-3-enecarboxylic acid

4-(4-methoxy-phenyl)-1-methyl-cyclohexanecarboxylic acid