112987-86-7 Usage
Molecular Weight
393.39 g/mol
Structure
The compound consists of a dioxoloisoquinoline ring system with a phenylmethylene group and an acetyloxy functional group.
Functional Groups
Carboxylic acid, ester, phenyl, and acetyloxy.
Stereochemistry
The compound has a Z configuration, indicating the arrangement of the phenylmethylene group.
Solubility
The solubility of 1,3-Dioxolo[4,5-g]isoquinoline-6(5H)-carboxylic acid,
5-[(acetyloxy)phenylmethylene]-7,8-dihydro-, ethyl ester, (Z)- is not explicitly mentioned, but it is likely to be soluble in organic solvents such as ethanol, methanol, or acetone.
Stability
The stability of the compound is not explicitly mentioned, but it is expected to be stable under normal conditions, as it is an organic compound.
Reactivity
The compound may undergo reactions such as hydrolysis, esterification, or substitution reactions, depending on the specific reaction conditions and reagents used.
Applications
Potential applications in pharmaceuticals, agrochemicals, and materials science, but further research is needed to explore its properties and potential uses.
Synthesis
The synthesis of 1,3-Dioxolo[4,5-g]isoquinoline-6(5H)-carboxylic acid,
5-[(acetyloxy)phenylmethylene]-7,8-dihydro-, ethyl ester, (Z)- is not explicitly mentioned, but it likely involves the formation of the dioxoloisoquinoline ring system, followed by the introduction of the phenylmethylene and acetyloxy groups, and finally, the formation of the ethyl ester.
Check Digit Verification of cas no
The CAS Registry Mumber 112987-86-7 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,2,9,8 and 7 respectively; the second part has 2 digits, 8 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 112987-86:
(8*1)+(7*1)+(6*2)+(5*9)+(4*8)+(3*7)+(2*8)+(1*6)=147
147 % 10 = 7
So 112987-86-7 is a valid CAS Registry Number.
112987-86-7Relevant academic research and scientific papers
Lenz, George R.,Costanza, Carl
, p. 1176 - 1183 (1988)
The products obtained from the lead tetraacetate (LTA) oxidation of N-acylbenzylidene isoquinoline enamides are a function of the type of carbonyl function in the enamide, the solvent,and the type of substitution on the benzylidene aromatic ring.The benzoyl enamides yield Z-β-acethoxy-substituted enamides.The ethoxycarbonyl enamides, containing electron-releasing substituents on the benzylidene ring, efficiently form oxazolones when oxidized with LTA in acetic acid.In the absence of electron-releasing substituents, ring opening occurs to form benzoin esters.When the same oxidation is conducted in benzene, the enamide double bond is converted into its diacetoxy derivative, which can undergo a variety of reactions.LTA oxidation of acetyl enamides results in cleavage of the acetyl group with ultimate formation of 1-benzoyl-3,4-dihydroisoquinolines and isoquinolines.Oxidation of the formyl enamide with LTA results in cleavage of the formyl group with formation of a variety of products.Most of these have an acetyl group in place of the original formyl and are the result of either cleavage of the benzylidene ring at the double bond, oxidation, and subsequent ring opening to a benzil or various other oxidative and rearrangement processes.
