Diisobutyl carbonate

Base Information

Chemical Name:Diisobutyl carbonate
CAS No.:539-92-4
Molecular Formula:C9H18 O3
Molecular Weight:174.24
Hs Code.:2920909090
European Community (EC) Number:208-730-3
NSC Number:4009
UNII:UN7NR8B1XJ
DSSTox Substance ID:DTXSID4060236
Nikkaji Number:J24.099K
Wikidata:Q81989067
Mol file:539-92-4.mol

Synonyms:Diisobutyl carbonate;539-92-4;Isobutyl carbonate;bis(2-methylpropyl) carbonate;Carbonic acid, bis(2-methylpropyl) ester;Carbonic acid, diisobutyl ester;diisobutylcarbonate;UN7NR8B1XJ;Carbonic acid diisobutyl ester;NSC 4009;NSC-4009;EINECS 208-730-3;di-iso-butyl carbonate;UNII-UN7NR8B1XJ;(iso-C4H9O)2C(O);SCHEMBL37351;DTXSID4060236;Carbonic acid, di-isobutyl ester;NSC4009;MFCD00026479;AKOS024333533;carbonic acid bis-(2-methylpropyl) ester;CS-0160242;D81477

Suppliers and Price of Diisobutyl carbonate

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
ISOBUTYL CARBONATE 95.00%
5MG
$ 504.72

Total 18 raw suppliers

Chemical Property of Diisobutyl carbonate

Chemical Property:

Vapor Pressure:0.554mmHg at 25°C
Refractive Index:1.4072 (estimate)
Boiling Point:190 °C at 760 mmHg
Flash Point:71.5 °C
PSA：35.53000
Density:0.928 g/cm³
LogP:2.45160
Storage Temp.:Inert atmosphere,Room Temperature
XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:174.125594432
Heavy Atom Count:12
Complexity:116

Purity/Quality:

99% ^*data from raw suppliers

ISOBUTYL CARBONATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)COC(=O)OCC(C)C

Technology Process of Diisobutyl carbonate

There total 23 articles about Diisobutyl carbonate 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: 92.0%

: 78-83-1
2-methyl-propan-1-ol

: 271798-12-0
(+/-)-4-methyl-1,3-dioxepan-2-one

: 539-92-4
diisobutyl carbonate

Guidance literature:: With 70percent zinc oxide, 15percent aluminum oxide, 14percent lanthanum oxide, 1percent cerium oxide, reducing by hydrogen; at 120 ℃; for 1h; under 30003 Torr; Large scale;

Reference yield: 63.0%

: 626-62-0
Cyclohexyl iodide

: 102804-50-2
N-(2-bromophenyl)-N-methylmethacrylamide

: 543-27-1
isobutyl chloroformate

: 539-92-4
diisobutyl carbonate

: 3-(2-cyclohexyl-2-oxoethyl)-1,3-dimethylindolin-2-one

Guidance literature:: With nickel(II) bromide dimethoxyethane; manganese; chloro-trimethyl-silane; 4,4'-dimethyl-2,2'-bipyridines; In tetrahydrofuran; N,N-dimethyl acetamide; at 40 ℃; for 12h; Reagent/catalyst; Solvent; Catalytic behavior; Sealed tube; Inert atmosphere;
DOI:10.1021/acs.orglett.9b02788

Reference yield: 60.0%

: 78-83-1
2-methyl-propan-1-ol

: 124-38-9,18923-20-1
carbon dioxide

: 539-92-4
diisobutyl carbonate

Guidance literature:: With 2-Cyanopyridine; cerium(IV) oxide; at 119.84 ℃; for 48h; under 37503.8 Torr; Autoclave;
DOI:10.1016/j.jcat.2014.07.022