6-(6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-6H-furo[3,4-g][1,3]benzodioxol-8-one;chloride


Chemical Name: 6-(6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-6H-furo[3,4-g][1,3]benzodioxol-8-one;chloride
CAS Number: 53552-05-9
Product Number: AG00DDV5(AGN-PC-071DSB)
Synonyms:
MDL No: MFCD00055233
Molecular Formula: C21H20ClNO6
Molecular Weight: 417.8396

Identification/Properties


Computed Properties
Molecular Weight:
417.842g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
1
Exact Mass:
417.098g/mol
Monoisotopic Mass:
417.098g/mol
Topological Polar Surface Area:
63.2A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
655
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



(-)-Bicuculline methochloride is a valuable compound that finds application in chemical synthesis as a versatile building block. With its unique chemical structure and reactivity, (-)-Bicuculline methochloride serves as a key intermediate in the preparation of various complex molecules. Its incorporation in organic synthesis processes enables the production of new compounds with diverse functionalities and properties. Chemists leverage the synthetic potential of (-)-Bicuculline methochloride to access novel structures and investigate their potential applications in pharmaceuticals, materials science, and other industrial sectors. Whether used as a reagent, catalyst, or precursor, this compound plays a crucial role in driving innovation and discovery in the field of chemical synthesis.