(S)-4-Phenyl-2-hexanone

Base Information

Chemical Name:(S)-4-Phenyl-2-hexanone
CAS No.:16460-85-8
Molecular Formula:C₁₂H₁₆O
Molecular Weight:176.258
Hs Code.:
DSSTox Substance ID:DTXSID70437985
Nikkaji Number:J59.138F
Wikidata:Q82253591
Mol file:16460-85-8.mol

Synonyms:CTK0E5875;(S)-4-Phenyl-2-hexanone;16460-85-8;DTXSID70437985

Suppliers and Price of (S)-4-Phenyl-2-hexanone

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 0 raw suppliers

Chemical Property of (S)-4-Phenyl-2-hexanone

Chemical Property:

XLogP3:2.7
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:: SDS file from LookChem

Useful:

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

Technology Process of (S)-4-Phenyl-2-hexanone

There total 35 articles about (S)-4-Phenyl-2-hexanone 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%

: 557-20-0
diethylzinc

: 122-57-6
1-Phenylbut-1-en-3-one

: 16460-85-8,68522-85-0,115651-75-7
(R)-4-phenylhexan-2-one

Guidance literature:: diethylzinc; With C₅₄H₃₇N₂O₂P; copper(II) acetylacetonate; In toluene; at 0 ℃; for 0.5h; Inert atmosphere;

1-Phenylbut-1-en-3-one; In toluene; at 0 ℃; for 1h; enantioselective reaction; Inert atmosphere;
DOI:10.1055/s-0033-1338439

Reference yield: 94.0%

: 557-20-0
diethylzinc

: 1896-62-4
(E)-benzalacetone

: 16460-85-8,68522-85-0,115651-75-7
(S)-4-phenylhexan-2-one

Guidance literature:: With copper(II) choride dihydrate; (R)-BINOL-XPHOS; In tetrahydrofuran; at -20 ℃; for 16h; optical yield given as %ee; enantioselective reaction;
DOI:10.1002/anie.200906839

Reference yield: 91.0%

: 557-20-0
diethylzinc

: 1896-62-4
(E)-benzalacetone

: 16460-85-8,68522-85-0,115651-75-7
(R)-4-phenylhexan-2-one

Guidance literature:: With (1R,2S)-2-(dibenzylamino)-1-(2-(diphenylphosphino)phenyl)propan-1-ol; copper(II) bis(trifluoromethanesulfonate); In hexane; dichloromethane; at 0 ℃; for 3h;
DOI:10.1021/ol0618306