3(4'-Chlorophenyl)-4,6-dimethylcoumarin structure

3(4'-Chlorophenyl)-4,6-dimethylcoumarin

3-(4-chlorophenyl)-4,6-dimethylchromen-2-one

Also Known As: 3-(4-chlorophenyl)-4,6-dimethylchromen-2-one|3(4'-Chlorophenyl)-4,6-dimethylcoumarin|3-(4'-Chlorophenyl)-4,6-dimethylcoumarin|3-(4 inverted exclamation mark -Chlorophenyl)-4,6-dimethylcoumarin

CAS: 720674-71-5
Molecular Formula C17H13ClO2
Molecular Weight 284.0604 g/mol
LogP 4.5
Topological Polar Surface Area 26.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 1
Exact Mass 284.0604
Monoisotopic Mass 284.0604
Heavy Atoms 20
Complexity 421.0

Chemical Identifiers

CAS Number 720674-71-5
SMILES CC1=CC2=C(C=C1)OC(=O)C(=C2C)C3=CC=C(C=C3)Cl
InChIKey RGNMXSPMIDBLKW-UHFFFAOYSA-N

Product Overview

3(4'-Chlorophenyl)-4,6-dimethylcoumarin (CAS 720674-71-5), with molecular formula C17H13ClO2 and molecular weight 284.0604 g/mol. IUPAC: 3-(4-chlorophenyl)-4,6-dimethylchromen-2-one.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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