9-beta-Hydroxyisovelleral
[CAS# 96910-71-3]

Identification

• Name: 9-beta-Hydroxyisovelleral
• Synonyms: 9Beta-Hydroxyisovelleral; Ccris 1700; Cycloprop(E)Indene-1A,2(1H)-Dicarboxaldehyde, 3A,4,5,6,6A,6B-Hexahydro-3A-Hydrox
• Molecular Formula: C₁₅H₂₀O₃
• Molecular Weight: 248.32
• CAS Registry Number: 96910-71-3
• SMILES: [C@@]12([C@](C1)([C@@H]3[C@](C=C2C=O)(CC(C3)(C)C)O)C)C=O
• InChI: 1S/C15H20O3/c1-12(2)5-11-13(3)8-14(13,9-17)10(6-16)4-15(11,18)7-12/h4,6,9,11,18H,5,7-8H2,1-3H3/t11-,13-,14-,15+/m1/s1
• InChIKey: XJHRNHWYRIVNAL-NGFQHRJXSA-N

Properties

• Density: 1.353g/cm³ (Cal.)
• Boiling point: 366.361°C at 760 mmHg (Cal.)
• Flash point: 189.553°C (Cal.)