1H-Indole-4-carboxylic acid, 1-methyl-


Chemical Name: 1H-Indole-4-carboxylic acid, 1-methyl-
CAS Number: 90924-06-4
Product Number: AG00GRZ7(AGN-PC-0037ZP)
Synonyms:
MDL No: MFCD08435874
Molecular Formula: C10H9NO2
Molecular Weight: 175.1840

Identification/Properties


Computed Properties
Molecular Weight:
175.187g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
175.063g/mol
Monoisotopic Mass:
175.063g/mol
Topological Polar Surface Area:
42.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
217
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
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


Other Analytical Data


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