(6S)-6-(2-Methyl-2-propanyl)-3,4,5,6-tetrahydrocyclopenta[b]pyran-7(2H)-one
[CAS# 748771-08-6]

Identification

• Name: (6S)-6-(2-Methyl-2-propanyl)-3,4,5,6-tetrahydrocyclopenta[b]pyran-7(2H)-one
• Synonyms: (S)-6-(tert-butyl)-3,4,5,6-tetrahydrocyclopenta[b]pyran-7(2H)-one
• Molecular Formula: C₁₂H₁₈O₂
• Molecular Weight: 194.27
• CAS Registry Number: 748771-08-6
• SMILES: O=C2C=1OCCCC=1C[C@H]2C(C)(C)C
• InChI: 1S/C12H18O2/c1-12(2,3)9-7-8-5-4-6-14-11(8)10(9)13/h9H,4-7H2,1-3H3/t9-/m1/s1
• InChIKey: IWWSGNWLOHGUQM-SECBINFHSA-N

Properties

• Density: 1.04g/cm³ (Cal.)
• Boiling point: 310.24°C at 760 mmHg (Cal.)
• Flash point: 134.679°C (Cal.)
• Refractive index: 1.499 (Cal.)