Eremophilenolide
[CAS# 4871-90-3]

Identification

• Name: Eremophilenolide
• Synonyms: (4Ar,5S,8Ar,9As)-3,4A,5-Trimethyl-4,5,6,7,8,8A,9,9A-Octahydrobenzo[F]Benzofuran-2-One; C09409; Eremophilenolide
• Molecular Formula: C₁₅H₂₂O₂
• Molecular Weight: 234.34
• CAS Registry Number: 4871-90-3
• SMILES: [C@H]13C(=C(C(=O)O1)C)C[C@@]2([C@H](CCC[C@@H]2C3)C)C
• InChI: 1S/C15H22O2/c1-9-5-4-6-11-7-13-12(8-15(9,11)3)10(2)14(16)17-13/h9,11,13H,4-8H2,1-3H3/t9-,11+,13-,15+/m0/s1
• InChIKey: AEQDXSFIHGWHDV-XPGAZNKBSA-N

Properties

• Density: 1.074g/cm³ (Cal.)
• Boiling point: 367.357°C at 760 mmHg (Cal.)
• Flash point: 153.804°C (Cal.)