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

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

CAS: 1547646-00-3

Formula: C8H7N3O3

SMILES: COC1=CC=C2C(NN=C2C(O)=O)=N1

IUPAC: 6-methoxy-1H-pyrazolo[3,4-b]pyridine-3-carboxylic acid

InChI: InChI=1S/C8H7N3O3/c1-14-5-3-2-4-6(8(12)13)10-11-7(4)9-5/h2-3H,1H3,(H,12,13)(H,9,10,11)

Composition: C (49.74%), H (3.65%), N (21.75%), O (24.85%)

Molar Mass: 193.162

Atom Count: 21

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 193.048741097
Formal Charge 0
FSP3 0.12
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey QLXQGJXBAMYPQW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.53
Topological Polar Surface Area 88.1
Polarizability 18.03
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 1547646-00-3 $315.25-$488.01$315.25$488.01
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