3-Methyl-3-buten-2-one

Base Information Edit

Chemical Name:3-Methyl-3-buten-2-one
CAS No.:814-78-8
Molecular Formula:C5H8O
Molecular Weight:84.1179
Hs Code.:2914190090
European Community (EC) Number:212-405-1
NSC Number:24150
UN Number:1246
UNII:F64867GQVB
DSSTox Substance ID:DTXSID9052557
Nikkaji Number:J35.118K
Wikidata:Q27160306
Metabolomics Workbench ID:44931
Mol file:814-78-8.mol

Synonyms:3-Methyl-3-buten-2-one;814-78-8;3-Methylbut-3-en-2-one;Isopropenyl methyl ketone;METHYL ISOPROPENYL KETONE;3-Buten-2-one, 3-methyl-;Methyl butenone;2-Methyl-1-buten-3-one;Ketone, methyl isopropenyl;Propen-2-yl methyl ketone;3-Methyl-3-butene-2-one;3-Methyl-3-buten-2-on;3-Methylene-2-butanone;2-Methyl-1-butene-3-one;3-Butene-2-one, 3-methyl;CCRIS 5317;HSDB 1164;3-Methyl-3-buten-2-on [German];EINECS 212-405-1;NSC 24150;UN1246;3-METHYL-3-BUTEN-2-ONE DIMER;BRN 1071241;3-methyl-but-3-en-2-one;UNII-F64867GQVB;F64867GQVB;CH2=C(CH3)C(=O)CH3;NSC-24150;4-01-00-03462 (Beilstein Handbook Reference);MFCD00059207;3-Methyl-3-buten-2-on (GERMAN);54789-11-6;methylisopropenylketon;3-Methyl-3-butenone;3-buten-2-ona, 3-metil-;WLN: 1VY1&U1;DTXSID9052557;3- Methyl-3- butene-2- one;CHEBI:88437;NSC24150;Methyl isopropenyl ketone, inhibited;3-Buten-2-one, 3-methyl-, dimer;NA1246;METHYL-3-BUTEN-2-ONE, 3-;3-Methyl-3-buten-2-one, AldrichCPR;AKOS015841085;LS-2910;UN 1246;METHYL ISOPROPENYL KETONE [HSDB];FT-0657882;M0378;EN300-80664;3-Methyl-3-buten-2-one (stabilized with HQ);D87596;A840140;3-METHYLBUT-3-EN-2-ONE(STABILIZED WITH HQ);Q27160306;3- Methyl-3- butene-2- one (methyl isopropenyl ketone);3-BUTEN,2-ONE,3-METHYL METHYL,ISOPROPENYL,KETONE;3-BUTEN,2-ONE,3-METHYL METHYL,ISOPROPENYL,KETONE;Methyl isopropenyl ketone, inhibited [UN1246] [Flammable liquid];Methyl isopropenyl ketone, inhibited [UN1246] [Flammable liquid]

Suppliers and Price of 3-Methyl-3-buten-2-one

Supply Marketing:Edit

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

Total 21 raw suppliers

Chemical Property of 3-Methyl-3-buten-2-one Edit

Chemical Property:

Appearance/Colour:clear colorless liquid
Vapor Pressure:4.314mmHg at 25°C
Melting Point:-54 °C
Refractive Index:1.425
Boiling Point:98 °C at 760 mmHg
Flash Point:11 °C
PSA：17.07000
Density:0.816 g/cm³
LogP:1.15150
XLogP3:0.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:84.057514874
Heavy Atom Count:6
Complexity:81.9
Transport DOT Label:Flammable Liquid

Purity/Quality:: ≥99.0% ^*data from raw suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Chemical Classes:Plastics & Rubber -> Other Monomers
Canonical SMILES:CC(=C)C(=O)C

Technology Process of 3-Methyl-3-buten-2-one

There total 64 articles about 3-Methyl-3-buten-2-one 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: 98.0%

: 78-80-8
2-methylbut-1-en-3-yne

: 814-78-8,25988-32-3
3-Methyl-3-buten-2-one

Guidance literature:: With disodium chloro[1,3-bis(2,6-diisopropyl-4-sodiumsulfonatophenyl)imidazol-2-ylidene]gold(I); water; at 100 ℃; for 2h;
DOI:10.1039/c5cy01278c

Reference yield: 79.0%

: 129156-01-0
(1,2-dimethyl-1-propenyl)dimethylphenylsilane

: 814-78-8,25988-32-3
3-Methyl-3-buten-2-one

: 1,1-dimethyl-2-(dimethylphenylsilyl)-2-butenyl hydroperoxide

Guidance literature:: With oxygen; 5,15,10,20-tetraphenylporphyrin; In dichloromethane; at -10 - -5 ℃; for 0.5h; Yields of byproduct given; Irradiation;
DOI:10.1021/jo00091a020