6H-Dibenzo[b,d]pyran-6-one


Chemical Name: 6H-Dibenzo[b,d]pyran-6-one
CAS Number: 2005-10-9
Product Number: AG002CTN(AGN-PC-0JKCQ2)
Synonyms:
MDL No:
Molecular Formula: C13H8O2
Molecular Weight: 196.2014

Identification/Properties


Properties
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
196.205g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
196.052g/mol
Monoisotopic Mass:
196.052g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
261
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



6H-Benzo[c]chromen-6-one, also known as coumarin, is a versatile compound commonly employed in chemical synthesis as a key building block for the construction of various pharmaceuticals, fragrances, and agricultural chemicals. In the field of organic chemistry, this heterocyclic compound serves as a crucial intermediate in the synthesis of structurally diverse molecules due to its unique aromatic properties and reactivity.One prominent application of 6H-Benzo[c]chromen-6-one in chemical synthesis is its role as a starting material for the preparation of coumarin derivatives with enhanced biological activities. By functionalizing the coumarin scaffold with specific substituents at different positions, researchers can modulate the pharmacological properties of these derivatives for applications in drug discovery and development. Furthermore, the ability of coumarin to undergo various chemical transformations, such as oxidation, reduction, and substitution reactions, makes it a valuable tool in the synthesis of complex organic molecules.Additionally, 6H-Benzo[c]chromen-6-one can be utilized in the development of new materials with unique properties. Its aromatic ring system and conjugated double bonds make it a useful building block for the design and synthesis of organic semiconductors, fluorescent dyes, and photovoltaic materials. By incorporating coumarin-based compounds into advanced materials, researchers can explore novel applications in optoelectronics, sensors, and energy storage devices.Overall, 6H-Benzo[c]chromen-6-one plays a crucial role in chemical synthesis by enabling the creation of diverse compounds with valuable properties for pharmaceutical, material science, and other industries. Its versatility and reactivity make it a powerful tool for researchers seeking to innovate in the field of organic chemistry.