3-Cyclohexyl-5-methyl-1,2-oxazole-4-carboxylic acid

Base Information

• Chemical Name: 3-Cyclohexyl-5-methyl-1,2-oxazole-4-carboxylic acid
• CAS No.: 55278-64-3
• Molecular Formula: C₁₁H₁₅NO₃
• Molecular Weight: 209.245
• European Community (EC) Number: 820-685-7
• ChEMBL ID: CHEMBL4909860
• Mol file: 55278-64-3.mol

Synonyms:3-cyclohexyl-5-methyl-1,2-oxazole-4-carboxylic acid;55278-64-3;CHEMBL4909860;AKOS013476611;CS-0259071;EN300-722390;3-cyclohexyl-5-methyl-1,2-oxazole-4-carboxylicacid;Z1201049392

Chemical Property of 3-Cyclohexyl-5-methyl-1,2-oxazole-4-carboxylic acid

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 209.10519334
• Heavy Atom Count: 15
• Complexity: 238

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C(=NO1)C2CCCCC2)C(=O)O

Technology Process of 3-Cyclohexyl-5-methyl-1,2-oxazole-4-carboxylic acid

There total 3 articles about 3-Cyclohexyl-5-methyl-1,2-oxazole-4-carboxylic 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:

3-cyclohexyl-5-methyl-isoxazole-4-carboxylic acid methyl ester (55278-59-6) → 3-Cyclohexyl-methyl-isoxazol-4-carbonsaeure (55278-64-3)

Guidance literature:

With potassium hydroxide; In ethanol; for 2h; Heating;

Reference yield:

cyclohexanecarbaldoxime (4715-11-1) → 3-Cyclohexyl-methyl-isoxazol-4-carbonsaeure (55278-64-3)

Guidance literature:

Multi-step reaction with 3 steps

1: Cl₂ / CHCl₃

2: methanol / Ambient temperature

3: KOH / aq. ethanol / 2 h / Heating

With potassium hydroxide; chlorine; In methanol; ethanol; chloroform;

Reference yield:

N-hydroxycyclohex-1-carbonimidoyl chloride (55278-53-0) → 3-Cyclohexyl-methyl-isoxazol-4-carbonsaeure (55278-64-3)

Guidance literature:

Multi-step reaction with 2 steps

1: methanol / Ambient temperature

2: KOH / aq. ethanol / 2 h / Heating

With potassium hydroxide; In methanol; ethanol;

upstream raw materials:

3-cyclohexyl-5-methyl-isoxazole-4-carboxylic acid methyl ester

cyclohexanecarbaldoxime

N-hydroxycyclohex-1-carbonimidoyl chloride

Downstream raw materials:

3-cyclohexyl-5-methyl-isoxazole-4-carbonyl chloride

3-Cyclohexyl-4-hydroxymethyl-5-methyl-isoxazol

3-Cyclohexyl-5-methyl-isoxazol-4-carbaldehyd

(3-cyclohexyl-5-methyl-isoxazol-4-yl)-acetic acid