1H-Indole-3-carboxylic acid, 5-amino-, methyl ester


Chemical Name: 1H-Indole-3-carboxylic acid, 5-amino-, methyl ester
CAS Number: 686747-19-3
Product Number: AG00FH73(AGN-PC-07AE24)
Synonyms:
MDL No:
Molecular Formula: C10H10N2O2
Molecular Weight: 190.1986

Identification/Properties


Computed Properties
Molecular Weight:
190.202g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
190.074g/mol
Monoisotopic Mass:
190.074g/mol
Topological Polar Surface Area:
68.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
232
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


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