Ethyl 5-hydroxy-2,2-dimethyl-3-oxopentanoate

Base Information

Chemical Name:Ethyl 5-hydroxy-2,2-dimethyl-3-oxopentanoate
CAS No.:84752-35-2
Molecular Formula:C9H16O4
Molecular Weight:188.224
Hs Code.:2918990090
DSSTox Substance ID:DTXSID10517811
Nikkaji Number:J1.548.028I
Wikidata:Q82380009
Mol file:84752-35-2.mol

Synonyms:ETHYL 5-HYDROXY-2,2-DIMETHYL-3-OXOPENTANOATE;84752-35-2;DTXSID10517811;MFCD14702878;AKOS006334778;SB85090;BS-38468;CS-0456145;ETHYL5-HYDROXY-2,2-DIMETHYL-3-OXOPENTANOATE;5-Hydroxy-2,2-dimethyl-3-oxo-pentanoic acid ethyl ester

Suppliers and Price of Ethyl 5-hydroxy-2,2-dimethyl-3-oxopentanoate

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

TRC
ethyl5-hydroxy-2,2-dimethyl-3-oxopentanoate
500mg
$ 220.00

ChemBridge Corporation
ethyl5-hydroxy-2,2-dimethyl-3-oxopentanoate 95%
1 g
$ 70.00

American Custom Chemicals Corporation
ETHYL 5-HYDROXY-2,2-DIMETHYL-3-OXOPENTANOATE 95.00%
1G
$ 721.59

Total 5 raw suppliers

Chemical Property of Ethyl 5-hydroxy-2,2-dimethyl-3-oxopentanoate

Chemical Property:

PSA：63.60000
LogP:0.52720
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:188.10485899
Heavy Atom Count:13
Complexity:196

Purity/Quality:

99% ^*data from raw suppliers

ethyl5-hydroxy-2,2-dimethyl-3-oxopentanoate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C(C)(C)C(=O)CCO

Technology Process of Ethyl 5-hydroxy-2,2-dimethyl-3-oxopentanoate

There total 3 articles about Ethyl 5-hydroxy-2,2-dimethyl-3-oxopentanoate 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: 71.0%

: 600-00-0
ethyl 2-bromoisobutyrate

: 109-78-4
3-Hydroxypropionitrile

: 84752-35-2
5-hydroxy-2,2-dimethyl-3-oxo-pentanoic ethyl ester

Guidance literature:: ethyl 2-bromoisobutyrate; 3-Hydroxypropionitrile; With zinc; In tetrahydrofuran;

With hydrogenchloride; In tetrahydrofuran;
DOI:10.1039/b101669p

Reference yield: 65.0%

: 84752-50-1
(E)-5-Hydroxy-2,2-dimethyl-3-oxo-pent-4-enoic acid ethyl ester

: 84752-35-2
5-hydroxy-2,2-dimethyl-3-oxo-pentanoic ethyl ester

Guidance literature:: With hydrogen; nickel; In ethanol; under 760 Torr; Ambient temperature;
DOI:10.1021/jo00155a029

Reference yield:

: 597-04-6
ethyl 2,2-dimethyl-3-oxobutanoate

: 84752-35-2
5-hydroxy-2,2-dimethyl-3-oxo-pentanoic ethyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) Na / 1.) anhydrous Et₂O, 0-5 deg C, 2.) abs. ethanol, 0 deg C, 6h, 3.) RT, 4.) abs. ethanol, 1h

2: 65 percent / H₂ / Raney nickel / ethanol / 760 Torr / Ambient temperature

With hydrogen; sodium; nickel; In ethanol;
DOI:10.1021/jo00155a029