1H-Pyrido[3,4-b]indole-1-carboxylic acid, 2,3,4,9-tetrahydro-6-methoxy-


Chemical Name: 1H-Pyrido[3,4-b]indole-1-carboxylic acid, 2,3,4,9-tetrahydro-6-methoxy-
CAS Number: 17952-63-5
Product Number: AG00271G(AGN-PC-0JVF0L)
Synonyms:
MDL No: MFCD00010826
Molecular Formula: C13H14N2O3
Molecular Weight: 246.2619

Identification/Properties


Computed Properties
Molecular Weight:
246.266g/mol
XLogP3:
-1
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
246.1g/mol
Monoisotopic Mass:
246.1g/mol
Topological Polar Surface Area:
74.4A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
336
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



6-Methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-1-carboxylic acid is a versatile compound that finds wide application in the field of chemical synthesis. As a key building block in organic chemistry, this compound serves as a crucial intermediate in the creation of various pharmaceuticals, agrochemicals, and materials.Its unique structure and properties make it invaluable in the synthesis of complex organic molecules. By serving as a starting material, 6-Methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-1-carboxylic acid enables the efficient construction of diverse molecular frameworks through strategic functional group manipulations and coupling reactions. Its presence in a synthetic route allows chemists to access a wide range of structurally diverse compounds, expanding the possibilities for creating new materials and drugs.Furthermore, the functional groups present in 6-Methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-1-carboxylic acid offer ample opportunities for further derivatization and modification, enhancing its utility as a synthetic building block. Overall, this compound plays a crucial role in enabling the efficient and strategic synthesis of complex organic molecules with diverse applications.