Ethyl 2-acetylheptanoate

Base Information

Chemical Name:Ethyl 2-acetylheptanoate
CAS No.:24317-94-0
Molecular Formula:C11H20O3
Molecular Weight:200.278
Hs Code.:2918300090
European Community (EC) Number:246-157-0
NSC Number:67887
UNII:S67X93ZTKQ
DSSTox Substance ID:DTXSID30865144
Nikkaji Number:J150.385E
Wikidata:Q27288718
Mol file:24317-94-0.mol

Synonyms:Ethyl 2-acetylheptanoate;24317-94-0;ethyl 2-pentylacetoacetate;Heptanoic acid, 2-acetyl-, ethyl ester;Ethyl 2-Amylacetoacetate;2-N-Amylacetoacetic acid ethyl ester;UNII-S67X93ZTKQ;S67X93ZTKQ;EINECS 246-157-0;NSC 67887;NSC-67887;AI3-06004;2-Acetylheptanoic Acid Ethyl Ester;ISOBORNYLISOVALERATE;ethyl 2 - acetylheptanoate;SCHEMBL4135628;DTXSID30865144;2-Acetylenanthic acid ethyl ester;ethyl ester2-acetyl-heptanoic acid;2-Amylacetoacetic Acid Ethyl Ester;NSC67887;MFCD00059380;STL283818;AKOS015831230;AS-58302;2-ACETYL-HEPTANOIC ACID ETHYL ESTER;A0444;FT-0719594;D88260;A817222;Q27288718

Suppliers and Price of Ethyl 2-acetylheptanoate

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-Amylacetoacetate >95.0%(GC)
5mL
$ 71.00

TCI Chemical
Ethyl 2-Amylacetoacetate >95.0%(GC)
25mL
$ 213.00

Sigma-Aldrich
2-ACETYL-HEPTANOIC ACID ETHYL ESTER Aldrich
25mg
$ 144.00

Matrix Scientific
Ethyl 2-acetylheptanoate
1g
$ 158.00

Matrix Scientific
Ethyl 2-acetylheptanoate
500mg
$ 126.00

Matrix Scientific
Ethyl 2-acetylheptanoate
5g
$ 483.00

Crysdot
Ethyl2-acetylheptanoate 95+%
100g
$ 545.00

American Custom Chemicals Corporation
ETHYL-2-ACETYLHEPTANOATE 95.00%
5G
$ 1016.40

American Custom Chemicals Corporation
ETHYL-2-ACETYLHEPTANOATE 95.00%
1G
$ 664.13

American Custom Chemicals Corporation
ETHYL-2-ACETYLHEPTANOATE 95.00%
0.5G
$ 616.00

Total 21 raw suppliers

Chemical Property of Ethyl 2-acetylheptanoate

Chemical Property:

Vapor Pressure:0.038mmHg at 25°C
Refractive Index:1.432
Boiling Point:240.4 °C at 760 mmHg
PKA:12.08±0.46(Predicted)
Flash Point:95.5 °C
PSA：43.37000
Density:0.948g/cm³
LogP:2.33500
Storage Temp.:Refrigerator, Under inert atmosphere
Solubility.:Chloroform (Slightly), Ethanol (Slightly)
XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:8
Exact Mass:200.14124450
Heavy Atom Count:14
Complexity:187

Purity/Quality:

97% ^*data from raw suppliers

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

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

Technology Process of Ethyl 2-acetylheptanoate

There total 5 articles about Ethyl 2-acetylheptanoate 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: 83.0%

: 110-53-2
1-Bromopentane

: 141-97-9
ethyl acetoacetate

: 24317-94-0
ethyl 2-acetylheptanoate

Guidance literature:: With potassium hydroxide; tetrabutylammomium bromide; potassium carbonate; at 100 - 105 ℃; for 0.0666667h; microwave irradiation;
DOI:10.1016/j.ejmech.2005.09.012