(5'S,6'R)-5',6'-Dihydroxy-1,1'-Bi(Cyclohexane)-1',3'-Dien-2-One
[CAS# 291749-99-0]

Identification

• Name: (5'S,6'R)-5',6'-Dihydroxy-1,1'-Bi(Cyclohexane)-1',3'-Dien-2-One
• Synonyms: (5'S,6'R)-5',6'-dihydroxy-[1,1'-bi(cyclohexane)]-1',3'-dien-2-one
• Molecular Formula: C₁₂H₁₆O₃
• Molecular Weight: 208.25
• CAS Registry Number: 291749-99-0
• SMILES: C1CCC(=O)C(C1)C2=CC=C[C@@H]([C@@H]2O)O
• InChI: 1S/C12H16O3/c13-10-6-2-1-4-8(10)9-5-3-7-11(14)12(9)15/h3,5,7-8,11-12,14-15H,1-2,4,6H2/t8?,11-,12+/m0/s1
• InChIKey: MBPVEBJKFNALAJ-DAPPQGSGSA-N

Properties

• Density: 1.289g/cm³ (Cal.)
• Boiling point: 387.22°C at 760 mmHg (Cal.)
• Flash point: 202.154°C (Cal.)
• Refractive index: 1.608 (Cal.)