6,7-Benzocoumarin

Base Information

• Chemical Name: 6,7-Benzocoumarin
• CAS No.: 3023-98-1
• Molecular Formula: C13H8 O2
• Molecular Weight: 196.2
• DSSTox Substance ID: DTXSID50429489
• Nikkaji Number: J883.001K
• Wikidata: Q27149404
• Mol file: 3023-98-1.mol

Synonyms:6,7-Benzocoumarin;2H-benzo[g]chromen-2-one;3023-98-1;benzocoumarin;benzo[g]chromen-2-one;SCHEMBL4346213;CHEBI:80382;DTXSID50429489;SY300599;Q27149404

Chemical Property of 6,7-Benzocoumarin

Chemical Property:

• PSA: 30.21000
• LogP: 2.94620
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 196.052429494
• Heavy Atom Count: 15
• Complexity: 295

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C=C3C(=CC2=C1)C=CC(=O)O3