ethyl (3R)-3-amino-3-(4-methylphenyl)propanoate

Base Information

Chemical Name:ethyl (3R)-3-amino-3-(4-methylphenyl)propanoate
CAS No.:758678-23-8
Molecular Formula:C₁₂H₁₇NO₂
Molecular Weight:207.272
Hs Code.:
DSSTox Substance ID:DTXSID20350438
Nikkaji Number:J1.687.340C
Wikidata:Q82126384
Mol file:758678-23-8.mol

Synonyms:758678-23-8;ethyl (3R)-3-amino-3-(4-methylphenyl)propanoate;(R)-3-AMINO-3-(4-TOLYL)PROPANOIC ACID ETHYL ESTER;(R)-Ethyl 3-amino-3-(p-tolyl)propanoate;SCHEMBL1138664;DTXSID20350438;AG-H-02541;EN300-4211092

Suppliers and Price of ethyl (3R)-3-amino-3-(4-methylphenyl)propanoate

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

American Custom Chemicals Corporation
(R)-BETA-(P-METHYLPHENYL)ALANINE ETHYL ESTER 95.00%
5MG
$ 498.51

Total 1 raw suppliers

Chemical Property of ethyl (3R)-3-amino-3-(4-methylphenyl)propanoate

Chemical Property:

PSA：52.32000
LogP:2.64830
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:207.125928785
Heavy Atom Count:15
Complexity:198

Purity/Quality:: (R)-BETA-(P-METHYLPHENYL)ALANINE ETHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of ethyl (3R)-3-amino-3-(4-methylphenyl)propanoate

There total 7 articles about ethyl (3R)-3-amino-3-(4-methylphenyl)propanoate 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: 40.0%

: 94104-32-2,758678-23-8
ethyl 3-amino-3-(4-tolyl)propionate

: 479065-00-4
(S)-3-amino-3-(4-methyl-phenyl)-propionic acid

: 758678-23-8
(R)-ethyl 3-amino-3-(4-tolyl)propionate

: 219813-90-8,758678-23-8
β-D-Phe(4-ME)-OEt

Guidance literature:: With potassium dihydrogenphosphate; water; Amano Lipase PS; at 30 ℃; for 16h; pH=8.2; Product distribution / selectivity; Resolution of racemate;

Reference yield: 40.0%

: 94104-32-2,758678-23-8
ethyl 3-amino-3-(4-tolyl)propionate

: 479065-00-4
(S)-3-amino-3-(4-methyl-phenyl)-propionic acid

: 758678-23-8
(R)-ethyl 3-amino-3-(4-tolyl)propionate

: 219813-90-8,758678-23-8
β-D-Phe(4-ME)-OEt

Guidance literature:: With potassium dihydrogenphosphate; water; Amano Lipase PS; at 30 ℃; for 16h; pH=8.2; Product distribution / selectivity; Resolution of racemate;

Reference yield:

: 91108-05-3
ethyl 3-amino-3-(p-tolyl)-2-propenoate

: 758678-23-8
(R)-ethyl 3-amino-3-(4-tolyl)propionate

: 219813-90-8,758678-23-8
β-D-Phe(4-ME)-OEt

Guidance literature:: With trichlorosilane; C₁₉H₃₂N₂O₂S; water; In toluene; at -40 ℃; for 36h; Overall yield = 90 %; enantioselective reaction; Inert atmosphere;
DOI:10.1002/adsc.201501061