Tomentosin
[CAS# 68736-88-9]

Identification

• Name: Tomentosin
• Synonyms: (3Ar,7S,8Ar)-7-Methyl-3-Methylene-6-(3-Oxobutyl)-4,7,8,8A-Tetrahydro-3Ah-Cyclohepta[D]Furan-2-One; (3Ar,7S,8Ar)-6-(3-Ketobutyl)-7-Methyl-3-Methylene-4,7,8,8A-Tetrahydro-3Ah-Cyclohepta[D]Furan-2-One; C09562
• Molecular Formula: C₁₅H₂₀O₃
• Molecular Weight: 248.32
• CAS Registry Number: 68736-88-9 (33649-15-9)
• SMILES: [C@H]12OC(C([C@H]1CC=C([C@H](C2)C)CCC(=O)C)=C)=O
• InChI: 1S/C15H20O3/c1-9-8-14-13(11(3)15(17)18-14)7-6-12(9)5-4-10(2)16/h6,9,13-14H,3-5,7-8H2,1-2H3/t9-,13+,14+/m0/s1
• InChIKey: AVFIYMSJDDGDBQ-CUOATXAZSA-N

Properties

• Density: 1.085g/cm³ (Cal.)
• Boiling point: 416.158°C at 760 mmHg (Cal.)
• Flash point: 185.145°C (Cal.)