methyl 6-methyl-1H-benzimidazole-2-carboxylate


Chemical Name: methyl 6-methyl-1H-benzimidazole-2-carboxylate
CAS Number: 87836-37-1
Product Number: AG004JNH(AGN-PC-07A9NQ)
Synonyms:
MDL No:
Molecular Formula: C10H10N2O2
Molecular Weight: 190.1986

Identification/Properties


Computed Properties
Molecular Weight:
190.202g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
190.074g/mol
Monoisotopic Mass:
190.074g/mol
Topological Polar Surface Area:
55A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
232
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



Methyl 6-methyl-1H-benzimidazole-2-carboxylate is a versatile compound widely used in chemical synthesis. It serves as a key building block for the preparation of various pharmaceuticals, agrochemicals, and fine chemicals due to its unique structural properties. This compound acts as a crucial intermediate in the synthesis of complex organic molecules, allowing chemists to efficiently access diverse chemical structures. Its presence enables the introduction of the benzimidazole moiety into target molecules, providing them with valuable biological activities or specific chemical properties. In the realm of drug discovery and material science, Methyl 6-methyl-1H-benzimidazole-2-carboxylate plays a significant role in the creation of novel compounds with potential applications in medicine, agriculture, and materials engineering.