Benzeneacetic-alpha-d acid, alpha-methyl-, methyl ester

Base Information

Chemical Name:Benzeneacetic-alpha-d acid, alpha-methyl-, methyl ester
CAS No.:85020-76-4
Molecular Formula:C₁₀H₁₂O₂
Molecular Weight:165.196
Hs Code.:
DSSTox Substance ID:DTXSID001241914

Synonyms:DTXSID001241914;Benzeneacetic-alpha-d acid, alpha-methyl-, methyl ester;85020-76-4

Suppliers and Price of Benzeneacetic-alpha-d acid, alpha-methyl-, methyl ester

Supply Marketing:

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

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Chemical Property of Benzeneacetic-alpha-d acid, alpha-methyl-, methyl ester

Chemical Property:

XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:165.090006367
Heavy Atom Count:12
Complexity:148

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of Benzeneacetic-alpha-d acid, alpha-methyl-, methyl ester

There total 5 articles about Benzeneacetic-alpha-d acid, alpha-methyl-, methyl 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: 83.0%

: 1455-13-6
deuteromethanol

: 2510-99-8
ethyl 2-phenylpropanoate

: 85020-76-4
methyl 2-deuterio-2-phenylpropionate

Guidance literature:: With sodium hydride; In tetrahydrofuran; at 0 - 20 ℃; for 12h;
DOI:10.1002/jlcr.1105

Reference yield: 75.0%

: 31508-44-8
2-phenylpropionic acid methyl ester

: 85020-76-4
methyl 2-deuterio-2-phenylpropionate

Guidance literature:: With [⁽²⁾H₆]acetone; potassium carbonate; 1-butyl-3-methylimidazolium chloride; at 80 ℃; for 12h;
DOI:10.1002/adsc.202001507

Reference yield: 75.0%

: 2328-26-9,28645-07-0,31508-44-8,34083-55-1
methyl (R)-2-phenylpropanoate

: 85020-76-4
methyl 2-deuterio-2-phenylpropionate

Guidance literature:: With [⁽²⁾H₆]acetone; potassium carbonate; 1-butyl-3-methylimidazolium chloride; at 80 ℃; for 12h;
DOI:10.1002/adsc.202001507