(1S-(1alpha,3abeta,4aalpha,11abeta,12R*))-2,3,3a,5,10,11a-Hexahydro-8-Hydroxy-3a,12-Dimethyl-5,10-Dioxo-1H-1,4a-Methanocyclopenta(b)Naphtho(2,3-e)Pyran-12-Carboxaldehyde
[CAS# 149471-07-8]

Identification

• Name: (1S-(1alpha,3abeta,4aalpha,11abeta,12R*))-2,3,3a,5,10,11a-Hexahydro-8-Hydroxy-3a,12-Dimethyl-5,10-Dioxo-1H-1,4a-Methanocyclopenta(b)Naphtho(2,3-e)Pyran-12-Carboxaldehyde
• Molecular Formula: C₂₀H₁₈O₅
• Molecular Weight: 338.36
• CAS Registry Number: 149471-07-8
• SMILES: [C@@H]15[C@@H]2[C@@](OC3([C@@]1(C=O)C)C(=C2)C(=O)C4=C(C3=O)C=CC(=C4)O)(CC5)C
• InChI: 1S/C20H18O5/c1-18(9-21)13-5-6-19(2)14(13)8-15-16(23)12-7-10(22)3-4-11(12)17(24)20(15,18)25-19/h3-4,7-9,13-14,22H,5-6H2,1-2H3/t13-,14-,18-,19+,20?/m1/s1
• InChIKey: NMLFNFAGOHGLMD-IKRSWNKOSA-N

Properties

• Density: 1.45g/cm³ (Cal.)
• Boiling point: 581.531°C at 760 mmHg (Cal.)
• Flash point: 214.096°C (Cal.)