Cyclohexanol, 3,4-dimethyl-


Chemical Name: Cyclohexanol, 3,4-dimethyl-
CAS Number: 5715-23-1
Product Number: AG003IIP(AGN-PC-00HO6Q)
Synonyms:
MDL No:
Molecular Formula: C8H16O
Molecular Weight: 128.2120

Identification/Properties


Properties
MP:
19.68°C (estimate)
BP:
190-193°C
Storage:
Room Temperature;
Form:
Liquid
Refractive Index:
1.4630-1.4660
Computed Properties
Molecular Weight:
128.215g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
128.12g/mol
Monoisotopic Mass:
128.12g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
90.6
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
3
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-H227
Precautionary Statements:
P501-P210-P280-P370+P378-P403+P235
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



3,4-Dimethylcyclohexanol, a versatile chemical compound, finds wide application in chemical synthesis. It serves as a valuable building block in organic chemistry, playing a crucial role in the creation of various pharmaceuticals, fragrances, and fine chemicals. This compound is particularly prized for its ability to undergo a range of chemical transformations, including oxidation, esterification, and hydrogenation reactions. Due to its unique structure, 3,4-Dimethylcyclohexanol enables the synthesis of complex molecules with specific stereochemical properties, making it an essential component in the production of diverse chemical products. Its utility extends to the manufacture of specialty polymers, agrochemicals, and flavoring agents, highlighting its significance in the realm of chemical synthesis.