methyl 2-amino-1H-benzimidazole-4-carboxylate


Chemical Name: methyl 2-amino-1H-benzimidazole-4-carboxylate
CAS Number: 910122-42-8
Product Number: AG003RMA(AGN-PC-04Q6Q1)
Synonyms:
MDL No: MFCD08436207
Molecular Formula: C9H9N3O2
Molecular Weight: 191.1867

Identification/Properties


Properties
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
191.19g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
191.069g/mol
Monoisotopic Mass:
191.069g/mol
Topological Polar Surface Area:
81A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
234
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



Methyl 2-amino-1H-benzo[d]imidazole-4-carboxylate is a versatile compound widely utilized in chemical synthesis. This compound plays a crucial role as a key building block in the creation of various organic molecules and pharmaceutical intermediates. With its unique structure and reactivity, Methyl 2-amino-1H-benzo[d]imidazole-4-carboxylate serves as a valuable starting material for the synthesis of complex heterocyclic compounds, which are essential in drug discovery and development. Its presence in a synthesis pathway can lead to the formation of new compounds with diverse biological activities and potential therapeutic properties. In the realm of chemical synthesis, this compound is an indispensable tool for creating innovative molecules with promising applications in medicine, materials science, and beyond.