1H-Indole-1-acetic acid, 2,3-dihydro-2-oxo-


Chemical Name: 1H-Indole-1-acetic acid, 2,3-dihydro-2-oxo-
CAS Number: 40380-68-5
Product Number: AG00CKEV(AGN-PC-02MCJT)
Synonyms:
MDL No:
Molecular Formula: C10H9NO3
Molecular Weight: 191.1834

Identification/Properties


Computed Properties
Molecular Weight:
191.186g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
191.058g/mol
Monoisotopic Mass:
191.058g/mol
Topological Polar Surface Area:
57.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
264
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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