Isocupressic acid
(1S,4aR,5S,8aR)-5-(5-hydroxy-3-methylpent-3-enyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
Also Known As: Isocupressic acid
CAS: 1909-91-7
| Molecular Formula | C20H32O3 |
|---|---|
| Molecular Weight | 320.23514 g/mol |
| LogP | 4.57 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 320.23514 |
| Heavy Atoms | 23 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 1909-91-7 |
|---|---|
| SMILES | CC(=CCO)CC[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@]2(C)C(=O)O)C |
Product Overview
Isocupressic acid (CAS 1909-91-7), with molecular formula C20H32O3 and molecular weight 320.23514 g/mol. IUPAC: (1S,4aR,5S,8aR)-5-(5-hydroxy-3-methylpent-3-enyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic 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.
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