3-[Hydroxy(phenyl)methyl]but-3-en-2-one

Base Information

Chemical Name:3-[Hydroxy(phenyl)methyl]but-3-en-2-one
CAS No.:73255-39-7
Molecular Formula:C11H12O2
Molecular Weight:176.215
Hs Code.:
DSSTox Substance ID:DTXSID90452953
Nikkaji Number:J959.901K
ChEMBL ID:CHEMBL1514906

Synonyms:3-[hydroxy(phenyl)methyl]but-3-en-2-one;STK329392;3-(hydroxy(phenyl)methyl)but-3-en-2-one;73255-39-7;CHEMBL1514906;DTXSID90452953;AKOS005437701;NCGC00161090-01;NCGC00161090-02;3-(alpha-Hydroxybenzyl)-3-butene-2-one

Suppliers and Price of 3-[Hydroxy(phenyl)methyl]but-3-en-2-one

Supply Marketing:

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

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Chemical Property of 3-[Hydroxy(phenyl)methyl]but-3-en-2-one

Chemical Property:

XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:176.083729621
Heavy Atom Count:13
Complexity:202

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 3-[Hydroxy(phenyl)methyl]but-3-en-2-one

There total 11 articles about 3-[Hydroxy(phenyl)methyl]but-3-en-2-one 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: 95.0%

: 100-52-7
benzaldehyde

: 1423-60-5
methyl ethynyl ketone

: 73255-39-7
3-(hydroxyphenylmethyl)but-3-en-2-one

Guidance literature:: methyl ethynyl ketone; With N-methyl-2-indolinone; diisobutylaluminium hydride; In tetrahydrofuran; hexane; at 0 - 20 ℃;

benzaldehyde; In tetrahydrofuran; hexane; at 20 ℃; for 4h;

Reference yield: 89.0%

: 100-52-7
benzaldehyde

: 78-94-4,25038-87-3
methyl vinyl ketone

: 73255-39-7
3-(hydroxyphenylmethyl)but-3-en-2-one

Guidance literature:: 1,4-diaza-bicyclo[2.2.2]octane; In various solvent(s); at 20 ℃; for 3h;
DOI:10.1016/j.tetlet.2004.05.153

Reference yield: 86.0%

: 100-52-7
benzaldehyde

: 78-94-4,25038-87-3
methyl vinyl ketone

: 42967-97-5
(3Z)-3-(bromomethyl)-4-phenylbut-3-en-2-one

: 73255-39-7
3-(hydroxyphenylmethyl)but-3-en-2-one

: (R*,S*)-3-bromomethyl-4-hydroxy-4-phenylbutan-2-one

: (R*,R*)-3-bromomethyl-4-hydroxy-4-phenylbutan-2-one

Guidance literature:: With boron tribromide-dimethyl sulfide complex; sodium hydrogencarbonate; In dichloromethane; at 0 - 20 ℃; for 13h;
DOI:10.1016/S0040-4020(01)00842-0