1,3,3a,4,7,7a-Hexahydro-4,7-methanoisobenzofuran
4-oxatricyclo[5.2.1.02,6]dec-8-ene
Also Known As: endo-4-Oxatricyclo[5.2.1.0(2,6)]dec-8-ene|1,3,3a,4,7,7a-Hexahydro-4,7-methanoisobenzofuran|4,7-Methanoisobenzofuran, 1,3,3a,4,7,7a-hexahydro-|1,3,3a,4,7,7a-Hexahydro-4,7-methano-2-benzofuran
CAS: 5263-63-8
| Molecular Formula | C9H12O |
|---|---|
| Molecular Weight | 136.08882 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.08882 |
| Monoisotopic Mass | 136.08882 |
| Heavy Atoms | 10 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 5263-63-8 |
|---|---|
| SMILES | C1C2C=CC1C3C2COC3 |
| InChIKey | KTONMPPWCXZPDT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (2 patents)
Product Overview
1,3,3a,4,7,7a-Hexahydro-4,7-methanoisobenzofuran (CAS 5263-63-8), with molecular formula C9H12O and molecular weight 136.08882 g/mol. IUPAC: 4-oxatricyclo[5.2.1.02,6]dec-8-ene.
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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