1H-Pyrazolo[4,3-b]pyridin-3(2H)-one - CAS 51617-92-6
Catalog: |
BB053419 |
Product Name: |
1H-Pyrazolo[4,3-b]pyridin-3(2H)-one |
CAS: |
51617-92-6 |
Synonyms: |
1,2-Dihydro-3H-pyrazolo[4,3-b]pyridin-3-one; 3H-Pyrazolo[4,3-b]pyridin-3-one, 1,2-dihydro-; 1H-Pyrazolo[4,3-b]pyridin-3-ol; 2H-pyrazolo[4,3-b]pyridin-3-ol |
IUPAC Name: | 1,2-dihydropyrazolo[4,3-b]pyridin-3-one |
Molecular Weight: | 135.12 |
Molecular Formula: | C6H5N3O |
Canonical SMILES: | C1=CC2=C(C(=O)NN2)N=C1 |
InChI: | InChI=1S/C6H5N3O/c10-6-5-4(8-9-6)2-1-3-7-5/h1-3H,(H2,8,9,10) |
InChI Key: | XBVTWEMNKKHPEH-UHFFFAOYSA-N |
Boiling Point: | 225.8±9.0°C (Predicted) |
Melting Point: | 247-248°C (dec.) |
Purity: | ≥97% |
Density: | 1.346±0.06 g/cm3 (Predicted) |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 135.043261791 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 135.043261791 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 54 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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