2(1H)-Naphthalenone, 8-bromo-3,4-dihydro-


Chemical Name: 2(1H)-Naphthalenone, 8-bromo-3,4-dihydro-
CAS Number: 117294-21-0
Product Number: AG000E2A(AGN-PC-0L5YPP)
Synonyms:
MDL No:
Molecular Formula: C10H9BrO
Molecular Weight: 225.0819

Identification/Properties


Computed Properties
Molecular Weight:
225.085g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
223.984g/mol
Monoisotopic Mass:
223.984g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
190
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



8-Bromo-3,4-dihydro-1H-naphthalen-2-one is a versatile compound commonly used in chemical synthesis processes. It serves as a valuable building block in the creation of various organic molecules and can be employed in the production of pharmaceuticals, agrochemicals, and advanced materials.As a synthetic intermediate, 8-Bromo-3,4-dihydro-1H-naphthalen-2-one facilitates the construction of complex molecular structures through its ability to participate in a range of chemical reactions. Its unique structure with a bromine atom and a carbonyl group offers opportunities for functional group transformations and further derivatization.In organic synthesis, 8-Bromo-3,4-dihydro-1H-naphthalen-2-one can be utilized to introduce specific functionalities or structural motifs into target molecules. Its presence can enable the selective modification of molecules, leading to the formation of new compounds with enhanced properties or biological activities.Furthermore, the reactivity of 8-Bromo-3,4-dihydro-1H-naphthalen-2-one allows for strategic bond formations, such as carbon-carbon or carbon-heteroatom bond formation, crucial in the construction of molecular scaffolds with desired properties. Its incorporation in multi-step synthesis routes can streamline the production of complex molecules and provide efficient access to valuable intermediates for further chemical manipulations.Overall, the application of 8-Bromo-3,4-dihydro-1H-naphthalen-2-one in chemical synthesis plays a pivotal role in the strategic design and preparation of diverse organic compounds with significance in various industrial sectors. Its versatility and reactivity make it a valuable tool for chemists seeking to access novel molecules and advance the field of organic chemistry.