CID 10899976

Base Information

• Chemical Name: CID 10899976
• CAS No.: 2899-36-7
• Molecular Formula: C7H16ClNO2S
• Molecular Weight: 213.729
• Hs Code.: 29309090
• Mol file: 2899-36-7.mol

Synonyms:

Chemical Property of CID 10899976

Chemical Property:

• Appearance/Colour: COA
• Vapor Pressure: 0.0142mmHg at 25°C
• Melting Point: 90-92 ºC
• Boiling Point: 257.9 °C at 760 mmHg
• Flash Point: 109.8 °C
• PSA: 77.62000
• LogP: 2.13220
• Storage Temp.: Store at RT.
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 213.0590276
• Heavy Atom Count: 12
• Complexity: 119

Purity/Quality:

99% ^*data from raw suppliers

L-Methionine ethyl ester HCl ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(CCSC)[NH3+].[Cl-]
• Isomeric SMILES: CCOC(=O)[C@H](CCSC)[NH3+].[Cl-]
• Uses: L-Methionine ethyl ester, Hydrochloride is a methionine ester with antioxidant properties.

Technology Process of CID 10899976

There total 1 articles about CID 10899976 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:

ethanol (64-17-5) + L-methionine (63-68-3,26062-47-5,58576-49-1) → L-methionine ethyl ester monohydrochloride (2899-36-7)

Guidance literature:

With hydrogenchloride;

Reference yield: 94.0%

ethyl[(4-nitrophenyl)methyl]amine (17847-35-7) + L-methionine ethyl ester monohydrochloride (2899-36-7) → ethyl (2S)-2-({ethyl[(4-nitrophenyl)methyl]carbamoyl}amino)-4-(methylsulfanyl)butanoate

Guidance literature:

L-methionine ethyl ester monohydrochloride; With N-ethyl-N,N-diisopropylamine; 1,1'-carbonyldiimidazole; In dichloromethane; at 20 ℃; for 6h;

ethyl[(4-nitrophenyl)methyl]amine; In dichloromethane; at 20 ℃;

Reference yield: 90.0%

L-methionine ethyl ester monohydrochloride (2899-36-7) + 2-nitrophenylsulphenyl-L-isoleucine dicyclohexylammonium salt (10382-52-2) → Nps-Ile-Met-OEt (97305-75-4)

Guidance literature:

With dicyclohexyl-carbodiimide; In chloroform; 1) -10 deg C, 2 h; 2) 2 h, room temperature;

upstream raw materials:

ethanol

L-methionine

Downstream raw materials:

N-((tert-butyloxy)carbonyl)-L-methionine p-nitrophenyl ester

(S)-2-[(S)-3-(4-Hydroxy-phenyl)-2-(toluene-4-sulfonylamino)-propionylamino]-4-methylsulfanyl-butyric acid ethyl ester

Nps-Leu-Met-OEt

(S)-methioninol

Refernces

• 1、 Xue, Si-Jia,Bu, Hong-Fei,Liu, Li,Xu, Xiao,Ma, Xubo,Zhu, Jun. "Optical activity 1,5-substituted-1,3,5-hexahydrotriazine-2-N-nitroimines: Synthesis and insecticidal activity". . p. 1067 - 1070. Retrieved 2013/10/21.
• 2、 Trentmann, Wilhelm,Mehler, Thomas,Martens, Juergen. "Sulfur-containing β-amino alcohols as catalysts in enantioselective synthesis". . p. 2033 - 2043. Retrieved 2007/10/03.