(3aR,6aR)-3,3A-Dihydroxy-4,5,6,6A-Tetrahydro-1(3aH)-Pentalenone
[CAS# 455892-99-6]

Identification

• Name: (3aR,6aR)-3,3A-Dihydroxy-4,5,6,6A-Tetrahydro-1(3aH)-Pentalenone
• Synonyms: (3aR,6aR)-3,3a-dihydroxy-4,5,6,6a-tetrahydropentalen-1(3aH)-one
• Molecular Formula: C₈H₁₀O₃
• Molecular Weight: 154.16
• CAS Registry Number: 455892-99-6
• SMILES: C1C[C@H]2C(=O)C=C([C@]2(C1)O)O
• InChI: 1S/C8H10O3/c9-6-4-7(10)8(11)3-1-2-5(6)8/h4-5,10-11H,1-3H2/t5-,8+/m0/s1
• InChIKey: HMHAZVOMZXWGLW-YLWLKBPMSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 328.6±42.0°C at 760 mmHg (Cal.)
• Flash point: 166.7±24.4°C (Cal.)
• Refractive index: 1.684 (Cal.)