1H-Imidazole, monohydrochloride


Chemical Name: 1H-Imidazole, monohydrochloride
CAS Number: 1467-16-9
Product Number: AG001E8N(AGN-PC-0PZ6SB)
Synonyms:
MDL No:
Molecular Formula: C3H5ClN2
Molecular Weight: 104.5382

Identification/Properties


Properties
MP:
158-161 °C(lit.)
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Solubility:
H2O: 50 mg/mL, clear, colorless
Computed Properties
Molecular Weight:
104.537g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
104.014g/mol
Monoisotopic Mass:
104.014g/mol
Topological Polar Surface Area:
28.7A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
28.1
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319
Precautionary Statements:
P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



1H-Imidazole hydrochloride is a versatile compound widely utilized in chemical synthesis as a key building block. It serves as a crucial intermediate in the production of various pharmaceuticals, agrochemicals, and fine chemicals. Due to its unique chemical properties, 1H-Imidazole hydrochloride enables the efficient formation of complex molecular structures through various synthetic routes. It acts as a catalyst, a ligand, or a nucleophilic reagent in a range of organic reactions, including nucleophilic substitutions, condensations, and ring-forming reactions. In addition, 1H-Imidazole hydrochloride plays a significant role in the synthesis of heterocyclic compounds, which are essential in medicinal chemistry and material science. Its diverse applications highlight its value as a crucial ingredient in the advancement of chemical synthesis methodologies.