Benzo[a]pyren-7(8H)-one, 9,10-dihydro-


Chemical Name: Benzo[a]pyren-7(8H)-one, 9,10-dihydro-
CAS Number: 3331-46-2
Product Number: AG00BY8S(AGN-PC-0JM1FT)
Synonyms:
MDL No:
Molecular Formula: C20H14O
Molecular Weight: 270.3246

Identification/Properties


Computed Properties
Molecular Weight:
270.331g/mol
XLogP3:
5.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
270.104g/mol
Monoisotopic Mass:
270.104g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
441
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



9,10-Dihydro-8H-benzo[def]chrysen-7-one, commonly known as $name$, is a versatile compound that plays a crucial role in chemical synthesis. Due to its unique chemical structure, $name$ is utilized as a key intermediate in the production of various advanced materials and complex organic compounds. This compound serves as a valuable building block in the synthesis of pharmaceuticals, agrochemicals, and organic dyes. In addition, $name$ is often employed as a precursor in the creation of novel heterocyclic compounds with diverse applications in medicinal chemistry and materials science. Its presence in the synthesis process enables the formation of intricate molecular architectures, making it an indispensable component in the realm of organic chemistry.