TRANS-4-GUANIDINOMETHYLCYCLOHEXANECARBOXYLIC ACID

Base Information

• Chemical Name: TRANS-4-GUANIDINOMETHYLCYCLOHEXANECARBOXYLIC ACID
• CAS No.: 38697-86-8
• Molecular Formula: C9H17N3O2
• Molecular Weight: 199.253
• Hs Code.: 2925290090
• Mol file: 38697-86-8.mol

Synonyms:TRANS-4-GUANIDINOMETHYLCYCLOHEXANECARBOXYLIC ACID;4β-(Guanidinomethyl)-1α-cyclohexanecarboxylic acid;(1r,4r)-4-(guanidinoMethyl)cyclohexanecarboxylic acid;trans-4-[[(Aminoiminomethyl)amino]methyl]cyclohexanecarboxylic acid

Chemical Property of TRANS-4-GUANIDINOMETHYLCYCLOHEXANECARBOXYLIC ACID

Chemical Property:

• Vapor Pressure: 1.7E-06mmHg at 25°C
• Boiling Point: 370.2°C at 760 mmHg
• Flash Point: 177.7°C
• PSA: 99.20000
• Density: 1.40
• LogP: 1.55140

Purity/Quality:

98%Min ^*data from raw suppliers

TRANS-4-GUANIDINOMETHYLCYCLOHEXANECARBOXYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of TRANS-4-GUANIDINOMETHYLCYCLOHEXANECARBOXYLIC ACID

There total 2 articles about TRANS-4-GUANIDINOMETHYLCYCLOHEXANECARBOXYLIC 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: 83.0%

trans-4-aminomethyl-cyclohexyl-carboxylic acid (1197-18-8) + methyl carbamimidothioate bis(sulfate) (867-44-7,2260-00-6,14527-26-5,147895-43-0) → 4-guanidinomethylcyclohexanecarboxylic acid (38697-86-8)

Guidance literature:

With sodium hydroxide; In water; Ambient temperature;

DOI:10.1248/cpb.33.647

Reference yield:

isothiourea sulphate (37622-16-5) + trans-4-aminomethyl-cyclohexyl-carboxylic acid (1197-18-8) → 4-guanidinomethylcyclohexanecarboxylic acid (38697-86-8)

Guidance literature:

With sodium hydroxide; In water;

Reference yield: 20.0%

4-guanidinomethylcyclohexanecarboxylic acid (38697-86-8) + ethyl 3-oxo-3-phenylpropionate (94-02-0) → 4-[(6-oxo-4-phenyl-1,6-dihydropyrimidin-2-ylamino)-methyl]cyclohexanecarboxylic acid ethyl ester

Guidance literature:

4-guanidinomethylcyclohexanecarboxylic acid; ethyl 3-oxo-3-phenylpropionate; at 180 ℃; for 2h;

With sulfuric acid; In ethanol; for 1h; Reflux;

DOI:10.1021/jm501313x

upstream raw materials:

trans-4-aminomethyl-cyclohexyl-carboxylic acid

methyl carbamimidothioate bis(sulfate)

isothiourea sulphate

Downstream raw materials:

4-Guanidinomethyl-cyclohexanecarboxylic acid 6-carbamimidoyl-naphthalen-2-yl ester; compound with methanesulfonic acid

Refernces

• 1、 Satoh,Muramatu,Ooi,Miyataka,Nakajima,Umeyama. "Medicinal chemical studies on synthetic protease inhibitors, trans-4-guanidinomethylcyclohexanecarboxylic acid aryl esters". . p. 647 - 654. Retrieved 2007/10/02.