4-OXO-1-PHENYLCYCLOHEXANECARBOXYLIC ACID

Base Information

• Chemical Name: 4-OXO-1-PHENYLCYCLOHEXANECARBOXYLIC ACID
• CAS No.: 75945-91-4
• Molecular Formula: C13H14O3
• Molecular Weight: 218.252
• Hs Code.: 2918300090
• Mol file: 75945-91-4.mol

Synonyms:1-phenyl-4-oxocyclohexanecarboxylic acid;4-oxo-1-phenylcyclohexanecarboxylic acid;4-OXO-PHENYLCYCLOHEXANECARBOXYLIC ACID;4-Oxo-1-phenyl-cyclohexancarbonsaeure;4-carboxy-4-phenyl-cyclohexanone;

Chemical Property of 4-OXO-1-PHENYLCYCLOHEXANECARBOXYLIC ACID

Chemical Property:

• Vapor Pressure: 2.05E-07mmHg at 25°C
• Melting Point: 120-121 °C(Solv: benzene (71-43-2))
• Boiling Point: 408.7°Cat760mmHg
• PKA: 3.98±0.20(Predicted)
• Flash Point: 215.2°C
• PSA: 54.37000
• Density: 1.227g/cm³
• LogP: 2.15210
• Storage Temp.: 2-8°C

Purity/Quality:

96% ^*data from raw suppliers

4-Oxo-1-phenylcyclohexanecarboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-OXO-1-PHENYLCYCLOHEXANECARBOXYLIC ACID

There total 12 articles about 4-OXO-1-PHENYLCYCLOHEXANECARBOXYLIC 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: 99.0%

dimethyl 4-oxo-1-phenyl-1,3-cyclohexanedicarboxylate (374794-40-8) → 4-oxo-1-phenylcyclohexanecarboxylic acid (75945-91-4)

Guidance literature:

With lithium hydroxide; water; In tetrahydrofuran; methanol; for 72h; Heating / reflux;

Reference yield: 99.0%

dimethyl 4-oxo-1-phenyl-1,3-cyclohexanedicarboxylate (951314-25-3) → 4-oxo-1-phenylcyclohexanecarboxylic acid (75945-91-4)

Guidance literature:

dimethyl 4-oxo-1-phenyl-1,3-cyclohexanedicarboxylate; With lithium hydroxide; In tetrahydrofuran; methanol; water; for 72h; Heating / reflux;

With hydrogenchloride; water; pH=1;

Reference yield: 92.0%

8-Phenyl-1,4-dioxaspiro<4.5>decan-8-carbonsaeure (51509-99-0) → 4-oxo-1-phenylcyclohexanecarboxylic acid (75945-91-4)

Guidance literature:

With acetic acid; for 24h; Heating;

DOI:10.1002/ardp.19803130603

upstream raw materials:

8-Phenyl-1,4-dioxaspiro<4.5>decan-8-carbonsaeure

acetic anhydride

acrylic acid methyl ester

benzeneacetic acid methyl ester

Downstream raw materials:

3,5-bis(trifluoromethyl)phenylmethyl 4-oxo-1-phenylcyclohexanecarboxylate

4-Oxo-1-phenylcyclohexylamine Hydrochloride

4-Oxo-1-phenyl-cyclohexancarbonsaeuremethylester

(cis-4-Methylamino-1-phenyl)-cyclohexancarbonsaeuremethylester

Refernces

• 1、 -. "Cyclohexyl derivatives and their use as therapeutic agents". Page 21. . Retrieved 2010/02/03.
• 2、 -. "Arylcycloalkane carboxylic esters, their use, pharmaceutical compositions and preparation". . . Retrieved 2008/06/13.