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23439-87-4 | 5H-Pyrrolo[3,4-b]pyridine-5,7(6H)-dione, 6-hydroxy-
CAS No: 23439-87-4 Catalog No: AG002N8F MDL No:MFCD11865269
Product Description
Catalog Number:
AG002N8F
Chemical Name:
5H-Pyrrolo[3,4-b]pyridine-5,7(6H)-dione, 6-hydroxy-
CAS Number:
23439-87-4
Molecular Formula:
C7H4N2O3
Molecular Weight:
164.1183
MDL Number:
MFCD11865269
IUPAC Name:
6-hydroxypyrrolo[3,4-b]pyridine-5,7-dione
InChI:
InChI=1S/C7H4N2O3/c10-6-4-2-1-3-8-5(4)7(11)9(6)12/h1-3,12H
InChI Key:
XCLIICWPGQIRDA-UHFFFAOYSA-N
SMILES:
O=C1c2ncccc2C(=O)N1O
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.022g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.12g/mol
Monoisotopic Mass:
164.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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