1H-Indole-2-carboxylic acid, 2,3-dihydro-


Chemical Name: 1H-Indole-2-carboxylic acid, 2,3-dihydro-
CAS Number: 78348-24-0
Product Number: AG001Y3Q(AGN-PC-0JLW1G)
Synonyms:
MDL No: MFCD00010635
Molecular Formula: C9H9NO2
Molecular Weight: 163.1733

Identification/Properties


Computed Properties
Molecular Weight:
163.176g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
163.063g/mol
Monoisotopic Mass:
163.063g/mol
Topological Polar Surface Area:
49.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
193
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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