1H-Inden-1-one, 2,3-dihydro-5,6-dimethyl-


Chemical Name: 1H-Inden-1-one, 2,3-dihydro-5,6-dimethyl-
CAS Number: 16440-97-4
Product Number: AG001UVR(AGN-PC-0JKJPU)
Synonyms:
MDL No:
Molecular Formula: C11H12O
Molecular Weight: 160.2124

Identification/Properties


Computed Properties
Molecular Weight:
160.216g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
160.089g/mol
Monoisotopic Mass:
160.089g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
197
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:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



5,6-Dimethyl-2,3-dihydro-1H-inden-1-one is a versatile compound widely used in chemical synthesis due to its unique structure and reactivity. In organic chemistry, this compound serves as a key building block for the synthesis of various aromatic compounds, such as pharmaceuticals, fragrances, and agrochemicals. Its substituted indenone moiety allows for the introduction of different functional groups, enabling the creation of a diverse range of chemical compounds. Additionally, 5,6-Dimethyl-2,3-dihydro-1H-inden-1-one can undergo various transformations, including oxidation, reduction, and substitution reactions, making it a valuable intermediate in the synthesis of complex organic molecules.