(1S,2R,6S,8S,13S)-8-(3-Furyl)-13-Methyl-5-Methylene-9,11-Dioxatetracyclo[8.6.0.0^1,6.0^2,13]Hexadecan-12-One
[CAS# 6813-08-7]

Identification

• Name: (1S,2R,6S,8S,13S)-8-(3-Furyl)-13-Methyl-5-Methylene-9,11-Dioxatetracyclo[8.6.0.0^1,6.0^2,13]Hexadecan-12-One
• Synonyms: 1,8-(Epoxymethano)-1H,3H-naphtho(8a,1-c)pyran-12-one, 3-(3-furanyl)decahydro-8-methyl-5-methylene-, (1S-(1α,3α,4aα,7aα,8β,11aR*))-; sciadin
• Molecular Formula: C₂₀H₂₄O₄
• Molecular Weight: 328.40
• CAS Registry Number: 6813-08-7
• SMILES: O=C4OC3O[C@H](c1ccoc1)C[C@H]2\C(=C)CC[C@@H]5[C@]23CCC[C@]45C
• InChI: 1S/C20H24O4/c1-12-4-5-16-19(2)7-3-8-20(16)14(12)10-15(13-6-9-22-11-13)23-18(20)24-17(19)21/h6,9,11,14-16,18H,1,3-5,7-8,10H2,2H3/t14-,15-,16-,18?,19+,20-/m0/s1
• InChIKey: SWGMICKEWPSAMT-IMAGCOIZSA-N

Properties

• Density: 1.232g/cm³ (Cal.)
• Boiling point: 477.873°C at 760 mmHg (Cal.)
• Flash point: 242.809°C (Cal.)