37132-68-6 Usage
Description
3-Aminobenzamidine Dihydrochloride Hydrate is an organic compound with the chemical formula C7H9N3.2HCl.H2O. It is a white, pink, or brownish powder that is soluble in water and has been identified for its potential applications in various fields due to its unique chemical properties.
Uses
Used in Pharmaceutical Industry:
3-Aminobenzamidine Dihydrochloride Hydrate is used as a reactant for the synthesis of N-phenylamidines, which are selective inhibitors of human neuronal nitric oxide synthase (nNOS). This application is significant because nNOS inhibitors can be utilized in the development of therapeutic agents for various neurological disorders, such as Alzheimer's disease, Parkinson's disease, and stroke.
Used in Chemical Synthesis:
Due to its unique chemical structure, 3-Aminobenzamidine Dihydrochloride Hydrate can be employed as an intermediate in the synthesis of various organic compounds, including pharmaceuticals, agrochemicals, and other specialty chemicals. Its versatility as a building block makes it a valuable asset in the chemical industry.
Used in Research and Development:
3-Aminobenzamidine Dihydrochloride Hydrate can be utilized in research and development settings to study the interactions of nNOS inhibitors with their target enzymes. This can lead to a better understanding of the underlying mechanisms of various diseases and the development of more effective treatments.
Check Digit Verification of cas no
The CAS Registry Mumber 37132-68-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,7,1,3 and 2 respectively; the second part has 2 digits, 6 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 37132-68:
(7*3)+(6*7)+(5*1)+(4*3)+(3*2)+(2*6)+(1*8)=106
106 % 10 = 6
So 37132-68-6 is a valid CAS Registry Number.
InChI:InChI=1/C7H9N3.2ClH/c8-6-3-1-2-5(4-6)7(9)10;;/h1-4H,8H2,(H3,9,10);2*1H
37132-68-6Relevant articles and documents
SUBSTITUENT EFFECTS ON THE pKa VALUES OF META- AND PARA-SUBSTITUTED BENSAMIDINIUM IONS
Rogana, Edyr,Nelson, David L.,Leite, Luiz F. F.,Mares-Guia, Marcos
, p. 2963 - 2975 (2007/10/02)
The pKa values of nine para-substituted derivatives of benzamidine (-NH2, -OH, -OCH3, -CH3, -F, -Cl, -Br, -COOC2H5 and -NO2), as well as four meta-substituted derivatives (-NH2, -CH3, -F, and -NO2), were measured by U.V. difference spectroscopy.The pKa values were interpreted in terms of the resonance structures and a strong correlation between the pKa values and the Hammett ? values of the substituent groups was obtained, with ρ = 1.41 +/- 0.08.The field effects of the substituent groups on the pKa values were calculated using the Kirkwood-Westheimer theory: a very small effect was found in the compounds studied.On the other hand, a strong correlation was observed between the pKa values and the charge densities at the central atom of the substituent groups, as calculated by molecular orbital theory.The analysis of these data suggests that the intramolecular charge transfer is an important factor in the consideration of the mechanism by which the substituent groups affect the pKa values.
