1-(2,6-Dihydroxyphenyl)butan-1-one

Base Information

Chemical Name:1-(2,6-Dihydroxyphenyl)butan-1-one
CAS No.:10121-26-3
Molecular Formula:C10H12O3
Molecular Weight:180.203
Hs Code.:
DSSTox Substance ID:DTXSID50399198
Nikkaji Number:J167.370J
Wikidata:Q82201597
Metabolomics Workbench ID:130972
ChEMBL ID:CHEMBL3274339
Mol file:10121-26-3.mol

Synonyms:1-(2,6-dihydroxyphenyl)butan-1-one;10121-26-3;1-Butanone, 1-(2,6-dihydroxyphenyl)-;Butyrylresorcin;2',6'-Dihydroxybutyrophenone;SCHEMBL4181492;CHEMBL3274339;GMFURTWBEPILKH-UHFFFAOYSA-;DTXSID50399198;Butyrophenone, 2',6'-dihydroxy-;AKOS024327776;InChI=1/C10H12O3/c1-2-4-7(11)10-8(12)5-3-6-9(10)13/h3,5-6,12-13H,2,4H2,1H3

Suppliers and Price of 1-(2,6-Dihydroxyphenyl)butan-1-one

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
Packaging
price

American Custom Chemicals Corporation
1-(2,6-DIHYDROXYPHENYL)-1-BUTANONE 95.00%
5MG
$ 503.12

Total 0 raw suppliers

Chemical Property of 1-(2,6-Dihydroxyphenyl)butan-1-one

Chemical Property:

Melting Point:120 °C(Solv: water (7732-18-5))
Boiling Point:292.0±20.0 °C(Predicted)
PSA：57.53000
Density:1.194±0.06 g/cm3(Predicted)
LogP:2.08060
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:180.078644241
Heavy Atom Count:13
Complexity:169

Purity/Quality:: 1-(2,6-DIHYDROXYPHENYL)-1-BUTANONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCC(=O)C1=C(C=CC=C1O)O

Technology Process of 1-(2,6-Dihydroxyphenyl)butan-1-one

There total 3 articles about 1-(2,6-Dihydroxyphenyl)butan-1-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:

: 556073-61-1
2-butyryl-3-hydroxy-cyclohex-2-enone

: 10121-26-3
1-(2,6-dihydroxyphenyl)-1-butanone

Guidance literature:: With sodium acetate; Mercurous acetate; In acetone; at 120 - 125 ℃; for 3h;

Reference yield:

: 90104-80-6
8-butyryl-7-hydroxy-4-methyl-coumarin

: 10121-26-3
1-(2,6-dihydroxyphenyl)-1-butanone

Guidance literature:: With sodium hydroxide;

Reference yield:

: 10121-26-3
1-(2,6-dihydroxyphenyl)-1-butanone

Guidance literature:: Resorcin, 1.) Acetessigester, H2SO4 (-> 7-Hydroxy-4-methylcumarin), 2.) Acylierung, 3.) AlCl3, Fries'sche Verschiebg., 4.) Hydrolyse;
DOI:10.1021/jm00219a017