(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydro-1H-quinolin-4-one
(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydro-1H-quinolin-4-one
Also Known As: Octahydro-quinolin-4-one|octahydro-4(1h)-quinolinone|ZERO/001739|(-)trans-(9s,10s)-4-ketoperhydroquinoline|(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydro-1H-quinolin-4-one
CAS: 58869-89-9
| Molecular Formula | C9H15NO |
|---|---|
| Molecular Weight | 153.11537 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 153.11537 |
| Monoisotopic Mass | 153.11537 |
| Heavy Atoms | 11 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 58869-89-9 |
|---|---|
| SMILES | C1CC[C@H]2[C@H](C1)C(=O)CCN2 |
| InChIKey | VZTBFFGJFFYFRT-YUMQZZPRSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (3 patents)
Pharmaceutical Intermediates (3 patents)
Product Overview
(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydro-1H-quinolin-4-one (CAS 58869-89-9), with molecular formula C9H15NO and molecular weight 153.11537 g/mol. IUPAC: (4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydro-1H-quinolin-4-one.
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 →
(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydro-1H-quinolin-4-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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