Arbusculin
[CAS# 24164-19-0]

Identification

• Name: Arbusculin
• Synonyms: (3As,5Ar,9Bs)-5A,9-Dimethyl-3-Methylene-4,5,6,7,8,9B-Hexahydro-3Ah-Benzo[G]Benzofuran-2-One; 3A,4,5,5A,6,7,8,9B-Octahydro-5A,9-Dimethyl-3-Methylenenaphtho(1,2-B)Furan-2(3H)-One (3As-(3Aalpha,5Abeta,9Bbeta))-; Arbusculin B
• Molecular Formula: C₁₅H₂₀O₂
• Molecular Weight: 232.32
• CAS Registry Number: 24164-19-0
• 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-CORIIIEPSA-N

Properties

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