4-(2-Acetyl-3-methyl-5-benzofuryl)furan-2(5H)-one

Base Information

• Chemical Name: 4-(2-Acetyl-3-methyl-5-benzofuryl)furan-2(5H)-one
• CAS No.: 3447-79-8
• Molecular Formula: C15H12O4
• Molecular Weight: 256.2534
• European Community (EC) Number: 222-366-2
• DSSTox Substance ID: DTXSID20188036
• Nikkaji Number: J216.124I
• Wikidata: Q83059811
• Mol file: 3447-79-8.mol

Synonyms:3447-79-8;4-(2-Acetyl-3-methyl-5-benzofuryl)furan-2(5H)-one;EINECS 222-366-2;3-(2-acetyl-3-methyl-1-benzofuran-5-yl)-2H-furan-5-one;4-(2-Acetyl-3-methylbenzofuran-5-yl)furan-2(5H)-one;DTXSID20188036;4-(2-Acetyl-3-methylbenzofuran-5-yl)-2(5H)-furanone

Chemical Property of 4-(2-Acetyl-3-methyl-5-benzofuryl)furan-2(5H)-one

Chemical Property:

• Vapor Pressure: 1.91E-09mmHg at 25°C
• Boiling Point: 481.9°Cat760mmHg
• Flash Point: 245.2°C
• PSA: 56.51000
• Density: 1.304g/cm³
• LogP: 2.88400
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 256.07355886
• Heavy Atom Count: 19
• Complexity: 439

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(OC2=C1C=C(C=C2)C3=CC(=O)OC3)C(=O)C

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