2-Hexanone, 5-(benzoyloxy)-

Base Information

Chemical Name:2-Hexanone, 5-(benzoyloxy)-
CAS No.:100612-64-4
Molecular Formula:C13H16O3
Molecular Weight:220.268
Hs Code.:
DSSTox Substance ID:DTXSID90447703
Nikkaji Number:J611.939E
Mol file:100612-64-4.mol

Synonyms:2-Hexanone, 5-(benzoyloxy)-;100612-64-4;5-Oxo-2-hexanol benzoate;DTXSID90447703

Suppliers and Price of 2-Hexanone, 5-(benzoyloxy)-

Supply Marketing:

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

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Chemical Property of 2-Hexanone, 5-(benzoyloxy)-

Chemical Property:

XLogP3:2.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:220.109944368
Heavy Atom Count:16
Complexity:242

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(CCC(=O)C)OC(=O)C1=CC=CC=C1

Technology Process of 2-Hexanone, 5-(benzoyloxy)-

There total 4 articles about 2-Hexanone, 5-(benzoyloxy)- 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: 100.0%

: 59694-06-3
2,5-hexanediol monobenzoate

: 100612-64-4
5-benzoyloxy-2-hexanone

Guidance literature:: With iodosylbenzene; potassium bromide; In water; for 4h;
DOI:10.1002/(SICI)1521-3773(20000403)39:7<1306::AID-ANIE1306>3.0.CO;2-J

Reference yield:

: 2935-44-6
hexane-2,5-diol

: 100612-64-4
5-benzoyloxy-2-hexanone

Guidance literature:: Multi-step reaction with 2 steps

1: 48 percent / pyridine / CHCl₃

2: 79 percent / PCC / CH₂Cl₂

With pyridine; pyridinium chlorochromate; In dichloromethane; chloroform;
DOI:10.1246/bcsj.60.1721

Reference yield:

: 98-88-4
benzoyl chloride

: 100612-64-4
5-benzoyloxy-2-hexanone

Guidance literature:: Multi-step reaction with 2 steps

1: 48 percent / pyridine / CHCl₃

2: 79 percent / PCC / CH₂Cl₂

With pyridine; pyridinium chlorochromate; In dichloromethane; chloroform;
DOI:10.1246/bcsj.60.1721