Isoquinoline aldoxime
N-(isoquinolin-1-ylmethylidene)hydroxylamine
Also Known As: isoquinoline aldoxime|1-isoquinolinecarboxaldehyde, oxime
CAS: 39977-76-9
| Molecular Formula | C10H8N2O |
|---|---|
| Molecular Weight | 172.06366 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.06366 |
| Monoisotopic Mass | 172.06366 |
| Heavy Atoms | 13 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 39977-76-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CN=C2C=NO |
| InChIKey | BNNLCFGFOMODGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (1 patents)
Product Overview
Isoquinoline aldoxime (CAS 39977-76-9), with molecular formula C10H8N2O and molecular weight 172.06366 g/mol. IUPAC: N-(isoquinolin-1-ylmethylidene)hydroxylamine.
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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