Hexyl pivalate

Base Information

Chemical Name:Hexyl pivalate
CAS No.:5434-57-1
Molecular Formula:C11H22 O2
Molecular Weight:186.294
Hs Code.:2915900090
European Community (EC) Number:226-602-5
NSC Number:15684
UNII:5D5OEG991O
DSSTox Substance ID:DTXSID9042045
Nikkaji Number:J126.055C
Wikidata:Q27261857
Mol file:5434-57-1.mol

Synonyms:Hexyl pivalate;1-Hexyl pivalate;Hexyl neopentanoate;Pivalic acid, hexyl ester;5434-57-1;Hexyl 2,2-dimethylpropanoate;Propanoic acid, 2,2-dimethyl-, hexyl ester;Hexyl 2,2-dimethylpropionate;NSC 15684;Propanoic acid, 2,2-dimethyl-, n-hexyl ester;EINECS 226-602-5;BRN 2205493;UNII-5D5OEG991O;AI3-20486;5D5OEG991O;NSC-15684;n-Hexyl pivalate;Pivalic acid hexyl ester;SCHEMBL417576;DTXSID9042045;NSC15684;AKOS006238547;2,2-Dimethylpropionic acid, hexyl ester;Propanoic acid,2-dimethyl-, hexyl ester;Propanoic acid,2,2-dimethyl-,hexyl ester;LS-117399;Q27261857

Suppliers and Price of Hexyl pivalate

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
HEXYL-2,2-DIMETHYLPROPANOATE 95.00%
5MG
$ 497.73

Total 10 raw suppliers

Chemical Property of Hexyl pivalate

Chemical Property:

Vapor Pressure:0.281mmHg at 25°C
Melting Point:-63.1°C (estimate)
Refractive Index:1.4228
Boiling Point:203.2°Cat760mmHg
Flash Point:76.7°C
PSA：26.30000
Density:0.871g/cm³
LogP:3.15600
XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:186.161979940
Heavy Atom Count:13
Complexity:145

Purity/Quality:

99% ^*data from raw suppliers

HEXYL-2,2-DIMETHYLPROPANOATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCCCCOC(=O)C(C)(C)C

Technology Process of Hexyl pivalate

There total 14 articles about Hexyl pivalate 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: 94.0%

: 111-27-3
hexan-1-ol

: 75-98-9
Trimethylacetic acid

: 5434-57-1
n-Hexyl pivalate

Guidance literature:: With glucose-diphenylaminium tosylate-derived carbon solid acid (GDTCSA); In n-heptane; at 80 ℃; for 6h;
DOI:10.1039/c4gc01395f