Benzenepropanoic-beta-d acid, beta-hydroxy-, ethyl ester

Base Information

Chemical Name:Benzenepropanoic-beta-d acid, beta-hydroxy-, ethyl ester
CAS No.:73738-25-7
Molecular Formula:C₁₁H₁₄O₃
Molecular Weight:195.222
Hs Code.:
DSSTox Substance ID:DTXSID801227764
Nikkaji Number:J2.317.042F

Synonyms:73738-25-7;Benzenepropanoic-beta-d acid, beta-hydroxy-, ethyl ester;DTXSID801227764

Suppliers and Price of Benzenepropanoic-beta-d acid, beta-hydroxy-, ethyl ester

Supply Marketing:

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

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Chemical Property of Benzenepropanoic-beta-d acid, beta-hydroxy-, ethyl ester

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:195.100571050
Heavy Atom Count:14
Complexity:173

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)CC(C1=CC=CC=C1)O
Isomeric SMILES:[2H]C(CC(=O)OCC)(C1=CC=CC=C1)O

Technology Process of Benzenepropanoic-beta-d acid, beta-hydroxy-, ethyl ester

There total 2 articles about Benzenepropanoic-beta-d acid, beta-hydroxy-, ethyl ester 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: 76.0%

: 94-02-0
ethyl 3-oxo-3-phenylpropionate

: 73738-25-7
ethyl 3-deutero-3-hydroxy-3-phenylpropanoate

Guidance literature:: With sodium borodeuteride; In methanol; ethyl acetate; at 0 ℃; for 0.5h;
DOI:10.1002/chem.201202631

Reference yield:

: 72656-47-4
ethyl (R)-3-hydroxy-3-phenylpropanoate

: 73738-25-7
ethyl 3-deutero-3-hydroxy-3-phenylpropanoate

Guidance literature:: Multi-step reaction with 2 steps

1: immobilised Candida parapsilosis ATCC 7330 whole cells / H₂O; ethanol / 25 °C

2: sodium borodeuteride

With sodium borodeuteride; immobilised Candida parapsilosis ATCC 7330 whole cells; In ethanol; water;
DOI:10.1016/j.tet.2006.03.045