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Home > Pyridines > 122706-49-4
122706-49-4 | 7H-Pyrrolo[3,4-b]pyridin-7-one, 5,6-dihydro-5-hydroxy-6-phenyl-
CAS No: 122706-49-4 Catalog No: AG000J0Z MDL No:
Product Description
Catalog Number:
AG000J0Z
Chemical Name:
7H-Pyrrolo[3,4-b]pyridin-7-one, 5,6-dihydro-5-hydroxy-6-phenyl-
CAS Number:
122706-49-4
Molecular Formula:
C13H10N2O2
Molecular Weight:
226.2307
IUPAC Name:
5-hydroxy-6-phenyl-5H-pyrrolo[3,4-b]pyridin-7-one
InChI:
InChI=1S/C13H10N2O2/c16-12-10-7-4-8-14-11(10)13(17)15(12)9-5-2-1-3-6-9/h1-8,12,16H
InChI Key:
CBLVQROEGOSBJR-UHFFFAOYSA-N
SMILES:
OC1N(c2ccccc2)C(=O)c2c1cccn2
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.074g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.235g/mol
Monoisotopic Mass:
226.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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