Frullanolide
[CAS# 27579-97-1]

Identification

• Name: Frullanolide
• Synonyms: (3As,5Ar,9Br)-5A,9-Dimethyl-3-Methylene-4,5,6,7,8,9B-Hexahydro-3Ah-Benzo[G]Benzofuran-2-One; Naphtho(1,2-B)Furan-2(3H)-One, 3A,4,5,5A,6,7,8,9B-Octahydro-5A,9-Dimethyl-3-Methylene-, (3As-(3Aalpha,5Abeta,9Balpha))-; Naphtho(1,2-B)Furan-2(3H)-One, 3A,4,5,5A,6,7,8,9B-Octahydro-5A,9-Dimethyl-3-Methylene-, (3Aalpha,5Abeta,9Balpha)-(+-)-
• Molecular Formula: C₁₅H₂₀O₂
• Molecular Weight: 232.32
• CAS Registry Number: 27579-97-1
• SMILES: [C@@H]12OC(=O)C([C@@H]1CC[C@@]3(C2=C(CCC3)C)C)=C
• InChI: 1S/C15H20O2/c1-9-5-4-7-15(3)8-6-11-10(2)14(16)17-13(11)12(9)15/h11,13H,2,4-8H2,1,3H3/t11-,13+,15+/m0/s1
• InChIKey: PJPHIAMRKUNVSU-NJZAAPMLSA-N

Properties

• Density: 1.092g/cm³ (Cal.)
• Boiling point: 378.039°C at 760 mmHg (Cal.)
• Flash point: 158.67°C (Cal.)