Scirpentriol
[CAS# 2270-41-9]

Identification

• Name: Scirpentriol
• Synonyms: Anguidine Deriv Scirpentriol; Bl 5731; Nsc269142
• Molecular Formula: C₁₅H₂₂O₅
• Molecular Weight: 282.34
• CAS Registry Number: 2270-41-9
• SMILES: [C@@H]13C=C(C)CC[C@]1(CO)[C@]4(C)[C@@]2(CO2)[C@H](O3)[C@@H]([C@H]4O)O
• InChI: 1S/C15H22O5/c1-8-3-4-14(6-16)9(5-8)20-12-10(17)11(18)13(14,2)15(12)7-19-15/h5,9-12,16-18H,3-4,6-7H2,1-2H3/t9-,10-,11-,12-,13-,14-,15-/m1/s1
• InChIKey: PXEBOIUZEXXBGH-GTJZFRISSA-N

Properties

• Density: 1.394g/cm³ (Cal.)
• Boiling point: 459.359°C at 760 mmHg (Cal.)
• Flash point: 231.612°C (Cal.)