Cycloheptanone, 2,2-dimethyl-


Chemical Name: Cycloheptanone, 2,2-dimethyl-
CAS Number: 7228-52-6
Product Number: AG01BXYU(AGN-PC-0NJR4H)
Synonyms:
MDL No:
Molecular Formula: C9H16O
Molecular Weight: 140.22274

Identification/Properties


Computed Properties
Molecular Weight:
140.226g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
140.12g/mol
Monoisotopic Mass:
140.12g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
136
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2,2-Dimethylcycloheptanone, also known as DMCH, is a versatile compound widely used in chemical synthesis. It serves as a key building block in the production of various pharmaceuticals, agrochemicals, and fragrance ingredients. In organic chemistry, 2,2-Dimethylcycloheptanone can undergo various transformations, such as oxidation, reduction, and functional group interconversions, to yield a range of valuable intermediates and final products. Its unique structure and reactivity make it a valuable tool for synthesizing complex organic molecules with high efficiency and selectivity. In addition, the presence of the dimethylcycloheptanone moiety in the synthesized compounds often imparts desirable properties such as increased stability, bioavailability, or sensory characteristics. Overall, the application of 2,2-Dimethylcycloheptanone in chemical synthesis offers chemists a powerful tool for designing and accessing novel compounds with diverse applications.