![7-oxo-7H-benzo[de]pyrazolo[5,1-a]isoquinoline-10,11-dicarboxylic acid structure](/static/products/4033/40331-21-3.webp)
7-oxo-7H-benzo[de]pyrazolo[5,1-a]isoquinoline-10,11-dicarboxylic acid
15-oxo-13,14-diazatetracyclo[7.6.1.05,16.010,14]hexadeca-1,3,5(16),6,8,10,12-heptaene-11,12-dicarboxylic acid
Also Known As: 7-oxo-7H-benzo(de)pyrazolo[5,1-a]isoquinoline-10,11-dicarbox|7-oxo-7H-benzo[de]pyrazolo[5,1-a]isoquinoline-10,11-dicarboxylic acid
CAS: 40331-21-3
| Molecular Formula | C16H8N2O5 |
|---|---|
| Molecular Weight | 308.04333 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 308.04333 |
| Monoisotopic Mass | 308.04333 |
| Heavy Atoms | 23 |
| Complexity | 565.0 |
Chemical Identifiers
| CAS Number | 40331-21-3 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C4=C(C(=NN4C(=O)C3=CC=C2)C(=O)O)C(=O)O |
| InChIKey | GIHFITKKGLIRLP-UHFFFAOYSA-N |
Product Overview
7-oxo-7H-benzo[de]pyrazolo[5,1-a]isoquinoline-10,11-dicarboxylic acid (CAS 40331-21-3), with molecular formula C16H8N2O5 and molecular weight 308.04333 g/mol. IUPAC: 15-oxo-13,14-diazatetracyclo[7.6.1.05,16.010,14]hexadeca-1,3,5(16),6,8,10,12-heptaene-11,12-dicarboxylic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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