Cyclohexanone, 3,5-dimethyl-


Chemical Name: Cyclohexanone, 3,5-dimethyl-
CAS Number: 2320-30-1
Product Number: AG002MI5(AGN-PC-0A2Q44)
Synonyms:
MDL No:
Molecular Formula: C8H14O
Molecular Weight: 126.1962

Identification/Properties


Properties
MP:
9.25°C (estimate)
BP:
182.5 °C at 760 mmHg
Storage:
Room Temperature;
Form:
Liquid
Refractive Index:
1.4410-1.4440
Computed Properties
Molecular Weight:
126.199g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
126.104g/mol
Monoisotopic Mass:
126.104g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
106
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback


Chemical Structure



Cyclohexanone, 3,5-dimethyl-, is a versatile compound widely employed in chemical synthesis for its unique properties and applications. This particular derivative of cyclohexanone offers significant advantages in various reactions due to its specific molecular structure and characteristics.In organic chemistry, Cyclohexanone, 3,5-dimethyl-, serves as a valuable building block in the synthesis of numerous complex organic molecules. Its cyclic structure provides a stable framework for various chemical transformations, allowing for the formation of diverse functional groups and stereoisomers. This compound is particularly useful in the preparation of pharmaceutical intermediates, agrochemicals, and specialty chemicals.Moreover, the 3,5-dimethyl substitution pattern in Cyclohexanone provides steric hindrance and altered reactivity, which can influence the selectivity and efficiency of certain reactions. This can be advantageous in controlling regioselectivity, diastereoselectivity, and enantioselectivity in organic synthesis processes. Additionally, the presence of the carbonyl group in Cyclohexanone facilitates nucleophilic addition reactions, enabling the introduction of various functional groups with high precision.Overall, Cyclohexanone, 3,5-dimethyl-, plays a vital role in the synthesis of complex organic molecules by offering tailored reactivity, selectivity, and structural diversity necessary for achieving desired chemical transformations and product outcomes.