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23439-88-5 | 1H-Pyrrolo[3,4-c]pyridine-1,3(2H)-dione, 2-hydroxy-
CAS No: 23439-88-5 Catalog No: AG002N8E MDL No:MFCD21609694
Product Description
Catalog Number:
AG002N8E
Chemical Name:
1H-Pyrrolo[3,4-c]pyridine-1,3(2H)-dione, 2-hydroxy-
CAS Number:
23439-88-5
Molecular Formula:
C7H4N2O3
Molecular Weight:
164.1183
MDL Number:
MFCD21609694
IUPAC Name:
2-hydroxypyrrolo[3,4-c]pyridine-1,3-dione
InChI:
InChI=1S/C7H4N2O3/c10-6-4-1-2-8-3-5(4)7(11)9(6)12/h1-3,12H
InChI Key:
HQQKPLKWXTZTQD-UHFFFAOYSA-N
SMILES:
O=C1c2cnccc2C(=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:
-0.7
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