5397-67-1 Usage
Uses
Used in Medicinal Chemistry:
1H,5H-Pyrazolo[1,2-a]pyrazole,tetrahydrois used as a potential scaffold for the development of new pharmaceutical drugs. Its unique structure and chemical properties make it a valuable candidate for the creation of novel therapeutic agents that could address various medical conditions.
Used in Drug Discovery and Development:
In the pharmaceutical industry, 1H,5H-Pyrazolo[1,2-a]pyrazole,tetrahydrois used as a starting point for the synthesis of new drug candidates. Its heterocyclic nature and the possibility of chemical modifications provide a versatile platform for the design of molecules with specific biological activities, potentially leading to the discovery of new treatments for a range of diseases.
Used in Chemical Research:
1H,5H-Pyrazolo[1,2-a]pyrazole,tetrahydrois also used in academic and industrial research settings to study the properties of heterocyclic compounds and their potential applications in various chemical and biological processes. This includes exploring its reactivity, stability, and interactions with other molecules, which can provide insights into the development of new materials and therapeutic agents.
Check Digit Verification of cas no
The CAS Registry Mumber 5397-67-1 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,3,9 and 7 respectively; the second part has 2 digits, 6 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 5397-67:
(6*5)+(5*3)+(4*9)+(3*7)+(2*6)+(1*7)=121
121 % 10 = 1
So 5397-67-1 is a valid CAS Registry Number.
InChI:InChI=1/C6H12N2/c1-3-7-5-2-6-8(7)4-1/h1-6H2
5397-67-1Relevant academic research and scientific papers
First synthesis and investigation of two hydroxyalkyl-substituted 2-tetrazenes
Porath, Bernd,Muenzenberg, Ralf,Heymanns, Peter,Rademacher, Paul,Boese, Roland,Blaeser, Dieter,Latz, Ruediger
, p. 1431 - 1440 (2007/10/03)
Two members of previously unknown hydroxyalkyl-2-tetrazenes (1a, 2a) have been synthesized and hydrogen bonding of these novel difunctional compounds has been investigated by spectroscopic (IR, 1H NMR, 15N NMR) and theoretical methods. The structures of 1a and its bis(trimethylsily 1) derivative 1b were determined by X-ray analysis. In the crystalline state, molecules 1a are associated by O-H...O hydrogen bonds that form a three-dimensional network. Ab initio HF and DFT as well as semiempirical SCF calculations show that O-H...N hydrogen bonds of 2-tetrazenes are medium strong. The δ-15N data and the quantum chemical calculations indicate that the amino nitrogen atoms of a 2-tetrazene are involved in intermolecular hydrogen bonding to a larger extent than the azo nitrogen atoms; the corresponding energy difference of the two types of hydrogen bonds is about 3 kJ mol-1. The hydrogen bonds can either stabilize or destabilize 2-tetrazenes thermodynamically depending on which nitrogen atoms are involved. Complexation of 1,1,4,4-tetramethyl-2-tetrazene with methanol is accompanied by only minor changes in geometric parameters whereas systematic effects on the electronic structure are more distinct. Transition states for N-N bond cleavage are stabilized to a larger extent making such compounds rather sensitive for thermal decomposition.
