116422-98-1 Usage
Description
4-Isoxazolepropanenitrile,3,5-dimethyl-(9CI) is a chemical compound that belongs to the class of isoxazole derivatives. It is a nitrile compound with the molecular formula C7H8N2O, and it exists as a colorless liquid. 4-Isoxazolepropanenitrile,3,5-dimethyl-(9CI) is known for its reactivity and potential as a building block for more complex molecules, making it a valuable asset in various fields.
Uses
Used in Pharmaceutical Research and Development:
4-Isoxazolepropanenitrile,3,5-dimethyl-(9CI) is used as a key intermediate in the synthesis of pharmaceuticals for its reactivity and ability to form more complex molecules. It plays a crucial role in the development of new drugs and medicines.
Used in Agrochemical Production:
In the agrochemical industry, 4-Isoxazolepropanenitrile,3,5-dimethyl-(9CI) is utilized as a building block for the creation of various agrochemicals. Its properties make it suitable for the development of pesticides, herbicides, and other agricultural chemicals.
Used in Organic Synthesis:
4-Isoxazolepropanenitrile,3,5-dimethyl-(9CI) is employed as a versatile reagent in organic synthesis. Its unique structure allows it to participate in a wide range of chemical reactions, contributing to the formation of diverse organic compounds.
Used in the Production of Fine Chemicals:
4-Isoxazolepropanenitrile,3,5-dimethyl-(9CI) is also used in the production of fine chemicals, which are high-purity chemicals used in various industries such as pharmaceuticals, fragrances, and flavors. Its reactivity and potential for forming complex molecules make it an essential component in the synthesis of these specialized chemicals.
Additionally, 4-Isoxazolepropanenitrile,3,5-dimethyl-(9CI) has been studied for its potential biological activities and pharmacological properties, indicating that it may have future applications in the development of new therapeutic agents or other biologically active compounds.
Check Digit Verification of cas no
The CAS Registry Mumber 116422-98-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,6,4,2 and 2 respectively; the second part has 2 digits, 9 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 116422-98:
(8*1)+(7*1)+(6*6)+(5*4)+(4*2)+(3*2)+(2*9)+(1*8)=111
111 % 10 = 1
So 116422-98-1 is a valid CAS Registry Number.
InChI:InChI=1/C8H10N2O/c1-6-8(4-3-5-9)7(2)11-10-6/h3-4H2,1-2H3
116422-98-1Relevant articles and documents
Synthesis of 6-Substituted 2-(N-Acetylamino)pyridines and 2-Aminopyridines by Cyclization of 5-Oximinoalkanenitriles
Vijn, Robert J.,Arts, Henricus J.,Maas, Peter J.,Castelijns, Anna M.
, p. 887 - 891 (2007/10/02)
Oxime derivatives of 5-oxoalkanenitriles (C6 chain or longer) were cyclized in most cases with a combination of AcCl and Ac2O, or Ac2O and HCl to 6-substituted 2-(N-acetylamino)pyridines.Alkaline hydrolysis gave the corresponding 2-aminopyridines in overall yields of 40-65 percent, with the exception of pyridine 3e.Oxime derivatives of 5-oxopentanenitriles did not cyclize but gave glutaronitriles instead.In some experiments with 5-oximinohexanenitrile (1a), 2,4-dimethyl-5-(2-cyanoethyl)oxazole (9) was detected in addition to the main product, 2-(N-acetylamino)-6-methylpyridine (2a).Formation of these compounds can be explained on the basis of a common intermediate 7 formed through rearrangement of the O-acetylated 5-oximinohexanenitrile (4).
