1-Pentanone, 3-methyl-1-phenyl-, (S)-

Base Information

Chemical Name:1-Pentanone, 3-methyl-1-phenyl-, (S)-
CAS No.:20659-68-1
Molecular Formula:C₁₂H₁₆O
Molecular Weight:176.258
Hs Code.:
DSSTox Substance ID:DTXSID70480956
Nikkaji Number:J84.342C
Wikidata:Q82316121

Synonyms:1-Pentanone, 3-methyl-1-phenyl-, (S)-;20659-68-1;SCHEMBL12158744;DTXSID70480956

Suppliers and Price of 1-Pentanone, 3-methyl-1-phenyl-, (S)-

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 1 raw suppliers

Chemical Property of 1-Pentanone, 3-methyl-1-phenyl-, (S)-

Chemical Property:

XLogP3:3.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:176.120115130
Heavy Atom Count:13
Complexity:157

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of 1-Pentanone, 3-methyl-1-phenyl-, (S)-

There total 14 articles about 1-Pentanone, 3-methyl-1-phenyl-, (S)- 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: 93.7%

: 28977-69-7,51116-72-4,116908-85-1
α(+)-2-Methylvalerylchlorid

: 71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1
benzene

: 20659-68-1,23033-63-8,115651-76-8
(+)-3-methylpentanoyl benzene

Guidance literature:: With aluminium trichloride; for 1.5h; Heating;

Reference yield: 90.0%

: 35660-91-4,35845-66-0,495-41-0
(E)-1-phenyl-2-buten-1-one

: 557-20-0
diethylzinc

: 23033-63-8,115651-76-8,20659-68-1
(S)-(+)-3-Methyl-1-phenyl-1-pentanon

Guidance literature:: With BF₄^(1-)*C₃₇H₃₅N₂O⁽¹⁺⁾; copper(II) bis(trifluoromethanesulfonate); sodium t-butanolate; In hexane; N,N-dimethyl-formamide; at -10 ℃; for 2h; optical yield given as %ee; enantioselective reaction; Inert atmosphere;
DOI:10.1016/j.tetlet.2009.06.026