Benzenemethanol, alpha-(1,1-dimethylethyl)-, 1-acetate, (alphaR)-

Base Information

Chemical Name:Benzenemethanol, alpha-(1,1-dimethylethyl)-, 1-acetate, (alphaR)-
CAS No.:23439-90-9
Molecular Formula:C₁₃H₁₈O₂
Molecular Weight:206.285
Hs Code.:
DSSTox Substance ID:DTXSID401197127
Nikkaji Number:J63.385B

Synonyms:SCHEMBL9607539;DTXSID401197127;23439-90-9;Benzenemethanol, alpha-(1,1-dimethylethyl)-, 1-acetate, (alphaR)-

Suppliers and Price of Benzenemethanol, alpha-(1,1-dimethylethyl)-, 1-acetate, (alphaR)-

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of Benzenemethanol, alpha-(1,1-dimethylethyl)-, 1-acetate, (alphaR)-

Chemical Property:

XLogP3:3.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:206.130679813
Heavy Atom Count:15
Complexity:209

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of Benzenemethanol, alpha-(1,1-dimethylethyl)-, 1-acetate, (alphaR)-

There total 10 articles about Benzenemethanol, alpha-(1,1-dimethylethyl)-, 1-acetate, (alphaR)- 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:

: 3835-64-1
2,2-dimethyl-1-phenylpropan-1-ol

: 108-24-7
acetic anhydride

: 23439-91-0,57377-60-3,3835-64-1,24867-90-1
(1S)-2,2-dimethyl-1-phenyl-1-propanol

: 23439-90-9
(R)-2,2-dimethyl-1-phenylpropyl acetate

: 23439-91-0
2,2-dimethyl-1-phenyl-1-propanol

: (S)-2,2-dimethyl-1-phenylpropyl acetate

Guidance literature:: tertiary amine-based nucleophilic catalyst; In tert-Amyl alcohol; at 0 ℃; for 12h;
DOI:10.1246/cl.2002.1114

Reference yield:

: 3835-64-1
2,2-dimethyl-1-phenylpropan-1-ol

: 108-24-7
acetic anhydride

: 23439-90-9
(R)-2,2-dimethyl-1-phenylpropyl acetate

: 23439-91-0
2,2-dimethyl-1-phenyl-1-propanol

: (S)-2,2-dimethyl-1-phenylpropyl acetate

Guidance literature:: With C₂₂H₃₀FeN₂; triethylamine; In diethyl ether; at 20 ℃; for 72h; Reagent/catalyst; Inert atmosphere; Schlenk technique; Resolution of racemate;
DOI:10.1021/acs.orglett.5b01044