Benzene, 4-(chloromethyl)-1,2-dimethyl-


Chemical Name: Benzene, 4-(chloromethyl)-1,2-dimethyl-
CAS Number: 102-46-5
Product Number: AG00068P(AGN-PC-0JL6XP)
Synonyms:
MDL No:
Molecular Formula: C9H11Cl
Molecular Weight: 154.6366

Identification/Properties


Computed Properties
Molecular Weight:
154.637g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
0
Rotatable Bond Count:
1
Exact Mass:
154.055g/mol
Monoisotopic Mass:
154.055g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
101
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



4-(Chloromethyl)-1,2-dimethylbenzene is a versatile compound frequently used in chemical synthesis due to its ability to serve as a valuable building block for the creation of various organic molecules. This compound's unique structure allows it to participate in a wide range of chemical reactions, making it a valuable tool for organic chemists looking to create complex molecular structures.One key application of 4-(Chloromethyl)-1,2-dimethylbenzene is in the synthesis of pharmaceutical compounds. Its chloromethyl group can undergo substitution reactions, enabling the introduction of different functional groups to tailor the properties of the final molecule. This versatility makes it a valuable intermediate in the production of a diverse range of pharmaceuticals, from antibiotics to anti-cancer agents.Furthermore, this compound can also be utilized in the development of agrochemicals and specialty chemicals. Its presence in the chemical industry is instrumental in the production of diverse products ranging from dyes and pigments to fragrances and flavors. By leveraging the reactivity of the chloromethyl group, chemists can manipulate the structure of 4-(Chloromethyl)-1,2-dimethylbenzene to access a myriad of compounds with varied properties and applications.In summary, 4-(Chloromethyl)-1,2-dimethylbenzene plays a crucial role in chemical synthesis by serving as a versatile building block for the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals. Its reactivity and flexibility make it an indispensable tool for organic chemists seeking to create novel molecules with diverse functionalities.