2,2-Dimethyl-3(2H)-furanone

Base Information

• Chemical Name: 2,2-Dimethyl-3(2H)-furanone
• CAS No.: 35298-48-7
• Molecular Formula: C6H8O2
• Molecular Weight: 112.128
• Hs Code.: 2932190090
• European Community (EC) Number: 623-609-9
• DSSTox Substance ID: DTXSID10188787
• Nikkaji Number: J323.881D
• Wikidata: Q72470520
• Mol file: 35298-48-7.mol

Synonyms:2,2-Dimethyl-3(2H)-furanone;35298-48-7;2,2-dimethylfuran-3-one;3(2H)-Furanone, 2,2-dimethyl-;2,2-dimethylfuran-3(2h)-one;2,2-dimethyl-2,3-dihydrofuran-3-one;2,5-Dimethyl-3(2H)furanone;2,2-dimethyl-furan-3-one;dimethyl-3(2h)-furanone;SCHEMBL183127;DTXSID10188787;HVNICCSXGONRCB-UHFFFAOYSA-N;AKOS015912801;2,2-Dimethyl-3(2H)-furanone, 96%;CS-0092873;FT-0755926;D87811;InChI=1/C6H8O2/c1-6(2)5(7)3-4-8-6/h3-4H,1-2H

Chemical Property of 2,2-Dimethyl-3(2H)-furanone

Chemical Property:

• Vapor Pressure: 1.55mmHg at 25°C
• Refractive Index: n20/D 1.455(lit.)
• Boiling Point: 155.5 °C at 760 mmHg
• Flash Point: 51.7 °C
• PSA: 26.30000
• Density: 1.038 g/cm³
• LogP: 0.87800
• Storage Temp.: 2-8°C
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 112.052429494
• Heavy Atom Count: 8
• Complexity: 145

Purity/Quality:

98.0% ^*data from raw suppliers

2,2-Dimethyl-3(2H)-furanone 96% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F,Xn
• Hazard Codes: F,Xn
• Statements: 10-43-36/38
• Safety Statements: 16-27-36/37/39-37/39-26-24/25

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1(C(=O)C=CO1)C
• Uses: 2,2-Dimethyl-3(2H)-furanone was used in the synthesis of epoxides via epoxidation. It was also used in the preparation of racemic methyl nonactate.