Ethyl 2-acetyloctanoate

Base Information

Chemical Name:Ethyl 2-acetyloctanoate
CAS No.:29214-60-6
Molecular Formula:C12H22 O3
Molecular Weight:214.305
Hs Code.:2918300090
European Community (EC) Number:249-518-0
UNII:6C0M05YGSF
DSSTox Substance ID:DTXSID3051969
Nikkaji Number:J60.804A
Wikidata:Q27264467
Mol file:29214-60-6.mol

Synonyms:Ethyl 2-acetyloctanoate;29214-60-6;Ethyl 2-acetylcaprylate;Ethyl 2-Hexylacetoacetate;Octanoic acid, 2-acetyl-, ethyl ester;n-Hexylethyl acetaoacetate;n-Hexylacetoacetic acid ethyl ester;Ethyl-2-hexyl acetoacetate;Ethyl-2-hexyl acetaoacetate;jasmin acetoacetate;Ethyl alpha-hexylacetoacetate;EINECS 249-518-0;UNII-6C0M05YGSF;BRN 1774721;6C0M05YGSF;3-03-00-01269 (Beilstein Handbook Reference);ethyl 2-n-hexylacetoacetate;2-acetyl-octanoic acid ethyl ester;GELSONE;ethyl 2 - acetyloctanoate;Ethyl 2-acetyloctanoate #;Ethyl 2-Acetyl-n-octanoate;SCHEMBL873537;Ethyl, 2-n-hexyl acetoacetate;DTXSID3051969;FEMA NO. 4459;Hexylacetoacetic Acid Ethyl Ester;MFCD00026889;2-Acetyl-n-octanoic Acid Ethyl Ester;AKOS015831214;N-HEXYLACETOACETICACIDETHYLESTER;ETHYL .ALPHA.-HEXYLACETOACETATE;(+/-)-ETHYL 2-ACETYLOCTANOATE;ETHYL 2-N-HEXYL-2-ACETOACETATE;LS-06675;LS-97943;ETHYL 2-ACETYLOCTANOATE, (+/-)-;CS-0450570;FT-0638839;H0129;D90804;A819817;Q27264467

Suppliers and Price of Ethyl 2-acetyloctanoate

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

TCI Chemical
Ethyl 2-Hexylacetoacetate >95.0%(GC)
25mL
$ 258.00

Matrix Scientific
Ethyl 2-acetyloctanoate
1g
$ 158.00

Matrix Scientific
Ethyl 2-acetyloctanoate
500mg
$ 126.00

Matrix Scientific
Ethyl 2-acetyloctanoate
5g
$ 483.00

Crysdot
Ethyl2-acetyloctanoate 95+%
100g
$ 440.00

American Custom Chemicals Corporation
N-HEXYLACETOACETIC ACID ETHYL ESTER 98.00%
5G
$ 1016.40

American Custom Chemicals Corporation
N-HEXYLACETOACETIC ACID ETHYL ESTER 98.00%
1G
$ 664.13

American Custom Chemicals Corporation
N-HEXYLACETOACETIC ACID ETHYL ESTER 98.00%
0.5G
$ 616.00

AK Scientific
Ethyl-2-n-hexylacetoacetate
25mL
$ 441.00

AHH
n-Hexylacetoaceticacidethylester 98%
0.5g
$ 588.00

Total 26 raw suppliers

Chemical Property of Ethyl 2-acetyloctanoate

Chemical Property:

Refractive Index:1.4320 to 1.4360
Boiling Point:253.8 ºC at 760 mmHg
PKA:11.89±0.59(Predicted)
Flash Point:101.7 ºC
PSA：43.37000
Density:0.941 g/cm³
LogP:2.72510
XLogP3:3.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:214.15689456
Heavy Atom Count:15
Complexity:199

Purity/Quality:

97% ^*data from raw suppliers

Ethyl 2-Hexylacetoacetate >95.0%(GC) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCC(C(=O)C)C(=O)OCC

Technology Process of Ethyl 2-acetyloctanoate

There total 8 articles about Ethyl 2-acetyloctanoate 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: 53.0%

: 111-25-1
1-bromo-hexane

: 141-97-9
ethyl acetoacetate

: 29214-60-6
ethyl 2-acetyloctanoate

Guidance literature:: ethyl acetoacetate; With sodium hydride; In tetrahydrofuran; at 0 - 60 ℃;

1-bromo-hexane; In tetrahydrofuran; at 100 ℃; Cooling with ice;
DOI:10.1016/j.bmc.2009.01.003

Reference yield: 33.0%

: 141-97-9
ethyl acetoacetate

: 638-45-9
1-Iodohexane

: 29214-60-6
ethyl 2-acetyloctanoate

Guidance literature:: ethyl acetoacetate; With sodium hydride; In tetrahydrofuran; at 0 ℃; for 1h; Inert atmosphere;

1-Iodohexane; In tetrahydrofuran; at 0 - 20 ℃; Inert atmosphere;
DOI:10.1002/adsc.201100215