Benzenemethanol, 3,5-dimethyl-


Chemical Name: Benzenemethanol, 3,5-dimethyl-
CAS Number: 27129-87-9
Product Number: AG003IOW(AGN-PC-0JKNAZ)
Synonyms:
MDL No:
Molecular Formula: C9H12O
Molecular Weight: 136.1910

Identification/Properties


Properties
MP:
218-221 °C(lit.);
BP:
219.5°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
n20/D 1.531(lit.)
Computed Properties
Molecular Weight:
136.194g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
136.089g/mol
Monoisotopic Mass:
136.089g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
90.9
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

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NMR Spectrum


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Chemical Structure



The unique compound, (3,5-Dimethylphenyl)methanol, serves as a versatile building block in chemical synthesis. Its strategic molecular structure enables it to participate in a variety of reactions, making it a valuable reagent in organic chemistry. Through selective functional group manipulations, (3,5-Dimethylphenyl)methanol can be transformed into a wide range of intermediate compounds with diverse properties.In the realm of organic synthesis, this compound finds extensive use as a precursor for the preparation of various pharmaceuticals, agrochemicals, fragrances, and advanced materials. Its ability to undergo substitution, reduction, and oxidation reactions provides synthetic chemists with a powerful tool for the creation of complex molecules. Additionally, the presence of the phenyl group offers the possibility of aromatic substitution reactions, further expanding its synthetic utility.Furthermore, (3,5-Dimethylphenyl)methanol plays a crucial role in the synthesis of chiral compounds due to the presence of stereocenters in its structure. By carefully controlling the stereochemistry during reactions involving this compound, chemists can access enantiomerically pure products, making it an indispensable component in asymmetric synthesis strategies.Overall, the application of (3,5-Dimethylphenyl)methanol in chemical synthesis showcases its significance as a key intermediate in the construction of diverse organic compounds with valuable properties and functionalities.