Butanoic acid, 2-hydroxy-2-methyl-, phenylmethyl ester, (2S)-

Base Information

Chemical Name:Butanoic acid, 2-hydroxy-2-methyl-, phenylmethyl ester, (2S)-
CAS No.:587832-08-4
Molecular Formula:C12H16O3
Molecular Weight:208.257
Hs Code.:
DSSTox Substance ID:DTXSID00473513
Nikkaji Number:J1.892.330K
Wikidata:Q82302952

Synonyms:587832-08-4;Butanoic acid, 2-hydroxy-2-methyl-, phenylmethyl ester, (2S)-;DTXSID00473513

Suppliers and Price of Butanoic acid, 2-hydroxy-2-methyl-, phenylmethyl ester, (2S)-

Supply Marketing:

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

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Chemical Property of Butanoic acid, 2-hydroxy-2-methyl-, phenylmethyl ester, (2S)-

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:208.109944368
Heavy Atom Count:15
Complexity:209

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(C)(C(=O)OCC1=CC=CC=C1)O
Isomeric SMILES:CC[C@@](C)(C(=O)OCC1=CC=CC=C1)O

Technology Process of Butanoic acid, 2-hydroxy-2-methyl-, phenylmethyl ester, (2S)-

There total 1 articles about Butanoic acid, 2-hydroxy-2-methyl-, phenylmethyl ester, (2S)- 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: 96.0%

: 37505-07-0
(S)-2-hydroxy-2-methylbutyric acid

: 100-39-0
benzyl bromide

: 587832-08-4
benzyl (S)-(+)-2-hydroxy-2-methylbutanoate

Guidance literature:: With potassium carbonate; In acetonitrile; at 20 ℃; for 36h;
DOI:10.1246/bcsj.79.780

Reference yield: 90.0%

: 587832-08-4
benzyl (S)-(+)-2-hydroxy-2-methylbutanoate

: 1092559-79-9
benzyl (R)-2-azido-2-methylbutanoate

Guidance literature:: With hydrogen azide; 1,1'-azodicarbonyl-dipiperidine; trimethylphosphane; In tetrahydrofuran; toluene; at 0 - 20 ℃; for 26h; Inert atmosphere;
DOI:10.1021/ol802325h