(3S)-3-(4-methoxyphenyl)butanoic acid

Base Information

Chemical Name:(3S)-3-(4-methoxyphenyl)butanoic acid
CAS No.:4842-61-9
Molecular Formula:C₁₁H₁₄O₃
Molecular Weight:194.23
Hs Code.:
European Community (EC) Number:897-922-6
Nikkaji Number:J70.836D

Synonyms:(3S)-3-(4-methoxyphenyl)butanoic acid;EN300-8637046;4842-61-9

Suppliers and Price of (3S)-3-(4-methoxyphenyl)butanoic acid

Supply Marketing:

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

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Chemical Property of (3S)-3-(4-methoxyphenyl)butanoic acid

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:194.094294304
Heavy Atom Count:14
Complexity:183

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of (3S)-3-(4-methoxyphenyl)butanoic acid

There total 19 articles about (3S)-3-(4-methoxyphenyl)butanoic 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: 69.0%

: 199006-83-2
(S,R)-(+)-N-(1-ethyl-2-hydroxy)ethyl-N-(2-fluorobenzyl)-3-(p-methoxyphenyl)butanamide

: 4842-61-9
(S)-(+)-4'-methoxy-3-phenylbutyric acid

Guidance literature:: With sulfuric acid; acetic acid; for 6h; Heating;

Reference yield: 43.0%

: 61292-83-9
(+/-)-ethyl 3-(4-methoxyphenyl)butanoate

: 405199-23-7
(R)-(-)-ethyl 3-(4-methoxyphenyl)butanoate

: 4842-61-9
(S)-(+)-4'-methoxy-3-phenylbutyric acid

Guidance literature:: With Pseudomonas fluorescens hydrolase; water; at 30 ℃; for 64h; pH=7; optical yield given as %ee; enantioselective reaction; aq. phosphate buffer; Enzymatic reaction;
DOI:10.1016/j.tetasy.2010.12.019

Reference yield:

: 104-92-7
1-bromo-4-methoxy-benzene

: 4842-61-9
(S)-(+)-4'-methoxy-3-phenylbutyric acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: Mg / tetrahydrofuran

1.2: ZnCl₂ / tetrahydrofuran / cooling

1.3: Pd(PPh₃)4 / tetrahydrofuran / 3 h / 0 °C

2.1: H₂; Et₃N / [Rh(S_P,R_C)-DuanPhos(nbd)]SbF₆ / methanol; H₂O / 12 h / 20 °C / 2280.15 Torr

With hydrogen; magnesium; triethylamine; [Rh(S_P,R_C)-DuanPhos(nbd)]SbF₆; In tetrahydrofuran; methanol; water;
DOI:10.1002/anie.200604810