1,7-dimethylbenzimidazol-2-amine


Chemical Name: 1,7-dimethylbenzimidazol-2-amine
CAS Number: 945021-49-8
Product Number: AG00IMN5(AGN-PC-0COPV8)
Synonyms:
MDL No: MFCD03725798
Molecular Formula: C9H11N3
Molecular Weight: 161.2037

Identification/Properties


Computed Properties
Molecular Weight:
161.208g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
161.095g/mol
Monoisotopic Mass:
161.095g/mol
Topological Polar Surface Area:
43.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
171
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



1,7-Dimethyl-1H-benzo[d]imidazol-2-amine, also known as $name$, exhibits versatile applications in chemical synthesis as a key intermediate. Its unique molecular structure allows for efficient functionalization, making it a valuable building block for the creation of various organic compounds. In particular, $name$ serves as a crucial starting material in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals due to its ability to undergo diverse chemical transformations. By participating in key synthetic reactions such as nucleophilic substitutions, formylation, and condensations, $name$ enables the construction of complex molecular frameworks with high precision and efficiency. This compound plays a pivotal role in the creation of novel chemical entities with enhanced biological, agricultural, or material properties, making it a valuable asset in the realm of organic synthesis.