5-Butyl-3-(furanylmethylene)-2(3H)-furanone

Base Information

• Chemical Name: 5-Butyl-3-(furanylmethylene)-2(3H)-furanone
• CAS No.: 120389-01-7
• Molecular Formula: C13H14 O3
• Molecular Weight: 218.2485
• Wikidata: Q76389696
• Mol file: 120389-01-7.mol

Synonyms:5-Butyl-3-(furanylmethylene)-2(3H)-furanone;2(3H)-Furanone, 5-butyl-3-(furanylmethylene)-;120389-01-7;LS-70332

Chemical Property of 5-Butyl-3-(furanylmethylene)-2(3H)-furanone

Chemical Property:

• Vapor Pressure: 1.96E-05mmHg at 25°C
• Boiling Point: 362.2°Cat760mmHg
• Flash Point: 172.9°C
• Density: 1.156g/cm³
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 218.094294304
• Heavy Atom Count: 16
• Complexity: 328

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC1=CC(=CC2=CC=CO2)C(=O)O1
• Isomeric SMILES: CCCCC1=C/C(=C\C2=CC=CO2)/C(=O)O1