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Home Carboxys 4-methoxy-1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

4-methoxy-1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

CAS No.:
1461706-97-7
Catalog Number:
AG01A5B3
Molecular Formula:
C9H9N3O3
Molecular Weight:
207.1861
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Product Description
Catalog Number:
AG01A5B3
Chemical Name:
4-methoxy-1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid
CAS Number:
1461706-97-7
Molecular Formula:
C9H9N3O3
Molecular Weight:
207.1861
MDL Number:
MFCD26407543
IUPAC Name:
4-methoxy-1-methylpyrazolo[3,4-b]pyridine-5-carboxylic acid
InChI:
InChI=1S/C9H9N3O3/c1-12-8-5(4-11-12)7(15-2)6(3-10-8)9(13)14/h3-4H,1-2H3,(H,13,14)
InChI Key:
QUBGVFFPCRREBN-UHFFFAOYSA-N
SMILES:
COc1c(cnc2c1cnn2C)C(=O)O
Properties
Complexity:
261  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
207.189g/mol
Monoisotopic Mass:
207.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties