Home Carboxys 1,3-dimethyl-4-oxo-1H,4H,7H-pyrazolo[3,4-b]pyridine-6-carboxylic acid

1,3-dimethyl-4-oxo-1H,4H,7H-pyrazolo[3,4-b]pyridine-6-carboxylic acid

CAS No.:
1375474-42-2
Catalog Number:
AG01AHJR
Molecular Formula:
C9H9N3O3
Molecular Weight:
207.1861
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Product Description
Catalog Number:
AG01AHJR
Chemical Name:
1,3-dimethyl-4-oxo-1H,4H,7H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
CAS Number:
1375474-42-2
Molecular Formula:
C9H9N3O3
Molecular Weight:
207.1861
MDL Number:
MFCD21602411
IUPAC Name:
1,3-dimethyl-4-oxo-7H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
InChI:
InChI=1S/C9H9N3O3/c1-4-7-6(13)3-5(9(14)15)10-8(7)12(2)11-4/h3H,1-2H3,(H,10,13)(H,14,15)
InChI Key:
VEXHUHPEINMORW-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(=O)c2c([nH]1)n(C)nc2C
Properties
Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.064g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
207.189g/mol
Monoisotopic Mass:
207.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties