1-Benzylguanidine


Chemical Name: 1-Benzylguanidine
CAS Number: 2211-57-6
Product Number: AG00705C(AGN-PC-0O7YWR)
Synonyms:
MDL No:
Molecular Formula: C10H15N3O2
Molecular Weight: 209.2450

Identification/Properties


Computed Properties
Molecular Weight:
149.197g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
149.095g/mol
Monoisotopic Mass:
149.095g/mol
Topological Polar Surface Area:
64.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
132
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#:
N/A
Hazard Statements:
-
Precautionary Statements:
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



1-Benzylguanidine, a versatile compound in chemical synthesis, serves as a valuable building block in various reactions due to its unique properties. This compound is commonly used as a reagent in the synthesis of various organic compounds, including pharmaceuticals and agrochemicals. Its ability to act as a base or a nucleophile makes it a crucial component in several organic transformations.In the field of medicinal chemistry, 1-Benzylguanidine is utilized to synthesize potential drug candidates by participating in key reactions such as cyclizations, amidations, and condensations. Its versatile reactivity allows for the efficient formation of numerous heterocyclic scaffolds, which are essential for drug development.Furthermore, in the realm of agrochemistry, 1-Benzylguanidine plays a significant role in the creation of pesticides and herbicides. By serving as a building block in the synthesis of various active ingredients, this compound enables the production of potent agrochemical formulations that combat pests and weeds effectively.Overall, 1-Benzylguanidine's diverse applications in chemical synthesis highlight its importance in the creation of valuable compounds across different industries, making it an indispensable tool for organic chemists worldwide.