H-CHA-OME HCL

Base Information

• Chemical Name: H-CHA-OME HCL
• CAS No.: 17193-39-4
• Molecular Formula: C10H19 N O2 . Cl H
• Molecular Weight: 221.727
• Hs Code.: 29224999
• Mol file: 17193-39-4.mol

Synonyms:Cyclohexanepropanoicacid, a-amino-, methyl ester,hydrochloride, (S)-; Cyclohexanepropanoic acid, a-amino-, methyl ester, hydrochloride, (aS)- (9CI); Cyclohexanepropionicacid, a-amino-, methyl ester,hydrochloride, L- (8CI); (S)-(-)-Cyclohexylalanine methyl ester hydrochloride;3-Cyclohexyl-L-alanine methyl ester hydrochloride; L-b-Cyclohexylalanine methyl esterhydrochloride; b-Cyclohexyl-L-alaninemethyl ester hydrochloride

Chemical Property of H-CHA-OME HCL

Chemical Property:

• PSA: 52.32000
• LogP: 2.95940
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C

Purity/Quality:

99% ^*data from raw suppliers

(S)-Methyl2-amino-3-cyclohexylpropanoatehydrochloride 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22-41

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of H-CHA-OME HCL

There total 9 articles about H-CHA-OME HCL 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: 97.0%

methanol (67-56-1) + L-cyclohexylalanine (27527-05-5) → methyl 3-cyclohexyl-L-alaninate hydrochloride (17193-39-4,144644-00-8)

Guidance literature:

With chloro-trimethyl-silane; Heating;

DOI:10.1016/j.tetasy.2004.05.032

Reference yield: 96.0%

methyl (2S)-2-amino-3-phenylpropanoate hydrochloride (7524-50-7) → methyl 3-cyclohexyl-L-alaninate hydrochloride (17193-39-4,144644-00-8)

Guidance literature:

With hydrogenchloride; hydrogen; In methanol; water; at 20 ℃; for 32h; under 760.051 Torr;

DOI:10.1055/s-0029-1216852

Reference yield: 88.0%

methyl S-3-cyclohexyl-2-(t-butoxycarbonylamino)propionate (98105-41-0) → methyl 3-cyclohexyl-L-alaninate hydrochloride (17193-39-4,144644-00-8)

Guidance literature:

With hydrogenchloride; In methanol; at 20 ℃; for 4h;

DOI:10.1021/op0200773

upstream raw materials:

methyl (2S)-2-amino-3-phenylpropanoate hydrochloride

methanol

L-cyclohexylalanine

(S)-2-amino-3-cyclohexylpropionic acid hydrochloride

Downstream raw materials:

methyl 2(S)-(N,N-dibenzylamino)-3-cyclohexylpropionate

β-cyclohexyl-L-alanine methyl ester isocyanate

C₂₄H₃₅N₃O₅

(S)-2-Benzyloxycarbonylamino-3-cyclohexyl-propionic acid methyl ester

Refernces

• 1、 Galasiti Kankanamalage, Anushka C.,Kim, Yunjeong,Weerawarna, Pathum M.,Uy, Roxanne Adeline Z.,Damalanka, Vishnu C.,Mandadapu, Sivakoteswara Rao,Alliston, Kevin R.,Mehzabeen, Nurjahan,Battaile, Kevin P.,Lovell, Scott,Chang, Kyeong-Ok,Groutas, William C.. "Structure-guided design and optimization of dipeptidyl inhibitors of norovirus 3CL protease. Structure-activity relationships and biochemical, X-ray crystallographic, cell-based, and in vivo studies". . p. 3144 - 3155. Retrieved 2015/04/27.
• 2、 Imramovsky, Ale?,Jorda, Radek,Pauk, Karel,?ezní?ková, Eva,Du?ek, Jan,Hanusek, Ji?í,Kry?tof, Vladimír. "Substituted 2-hydroxy-N-(arylalkyl)benzamides induce apoptosis in cancer cell lines". supporting information. p. 253 - 259. Retrieved 2013/10/01.