2-Acetyl-5-benzofurancarbonitrile

Base Information

• Chemical Name: 2-Acetyl-5-benzofurancarbonitrile
• CAS No.: 80531-14-2
• Molecular Formula: C₁₁H₇NO₂
• Molecular Weight: 185.182
• DSSTox Substance ID: DTXSID101299316
• Mol file: 80531-14-2.mol

Synonyms:2-acetyl-5-benzofurancarbonitrile;80531-14-2;SCHEMBL7384075;VNCNZKCYQHBSKA-UHFFFAOYSA-N;DTXSID101299316

Chemical Property of 2-Acetyl-5-benzofurancarbonitrile

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 185.047678466
• Heavy Atom Count: 14
• Complexity: 291

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC2=C(O1)C=CC(=C2)C#N