N-(1S-Ethoxycarbonyl-3-phenylpropyl)-D-alanine

Base Information

Chemical Name:N-(1S-Ethoxycarbonyl-3-phenylpropyl)-D-alanine
CAS No.:85196-26-5
Molecular Formula:C₁₅H₂₁NO₄
Molecular Weight:279.336
Hs Code.:
UNII:S2LLY46BRA

Synonyms:S2LLY46BRA;85196-26-5;UNII-S2LLY46BRA;N-(1S-Ethoxycarbonyl-3-phenylpropyl)-D-alanine;Benzenebutanoic acid, alpha-(((1R)-1-carboxyethyl)amino)-, monoethyl ester, (alphaS)-;SCHEMBL4669921;(2R)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid;AKOS016038596;BENZENEBUTANOIC ACID, .ALPHA.-(((1R)-1-CARBOXYETHYL)AMINO)-, MONOETHYL ESTER, (.ALPHA.S)-

Suppliers and Price of N-(1S-Ethoxycarbonyl-3-phenylpropyl)-D-alanine

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 5 raw suppliers

Chemical Property of N-(1S-Ethoxycarbonyl-3-phenylpropyl)-D-alanine

Chemical Property:

XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:279.14705815
Heavy Atom Count:20
Complexity:313

Purity/Quality:: 98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)O
Isomeric SMILES:CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@H](C)C(=O)O

Technology Process of N-(1S-Ethoxycarbonyl-3-phenylpropyl)-D-alanine

There total 8 articles about N-(1S-Ethoxycarbonyl-3-phenylpropyl)-D-alanine 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: 95.1%

: 111542-00-8
(S)-2-((R)-1-Benzyloxycarbonyl-ethylamino)-4-phenyl-butyric acid ethyl ester; hydrochloride

: 85196-26-5,122076-80-6
(2R)-2-amino>propionic acid

Guidance literature:: With hydrogen; palladium; In ethanol; for 3h; under 760 Torr; Ambient temperature;
DOI:10.1021/jm00122a003

Reference yield:

: 46460-23-5
ethyl 2-amino-4-phenyl-(2S)-butyrate

: 93836-48-7
(S)-2-(trifluoromethanesulphonyloxy)propionic acid benzyl ester

: 82717-96-2,122076-80-6
[1(S)-(ethoxycarbonyl)-3-phenylpropyl]-(S)-alanine

: 85196-26-5,122076-80-6
(2R)-2-amino>propionic acid

Guidance literature:: With formic acid; tributyl-amine; palladium on activated charcoal; Yield given. Multistep reaction; 1.) CH₂Cl₂, -20 deg C, 2 h, 2.) methanol, 2 h;
DOI:10.1002/ardp.19943271111

Reference yield:

: 943-73-7
D-homophenylalanine

: 85196-26-5,122076-80-6
(2R)-2-amino>propionic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 84.9 percent / 1.) HCl, 2.) Na₂CO₃

2: 1.) tributylamine, 2.) HCOOH / 2.) 20percent Pd/C / 1.) CH₂Cl₂, -20 deg C, 2 h, 2.) methanol, 2 h

With hydrogenchloride; formic acid; tributyl-amine; sodium carbonate; palladium on activated charcoal;
DOI:10.1002/ardp.19943271111