(6R,6aS,7R,9aR)-6-Hydroxy-7-methyloctahydrocyclopenta[b]oxocin-2(3H)-one
[CAS# 642071-89-4]

Identification

• Name: (6R,6aS,7R,9aR)-6-Hydroxy-7-methyloctahydrocyclopenta[b]oxocin-2(3H)-one
• Synonyms: (6R,6aS,7R,9aR)-6-hydroxy-7-methyloctahydrocyclopenta[b]oxocin-2(3H)-one
• Molecular Formula: C₁₁H₁₈O₃
• Molecular Weight: 198.26
• CAS Registry Number: 642071-89-4
• SMILES: C[C@@H]1CC[C@@H]2[C@@H]1[C@@H](CCCC(=O)O2)O
• InChI: 1S/C11H18O3/c1-7-5-6-9-11(7)8(12)3-2-4-10(13)14-9/h7-9,11-12H,2-6H2,1H3/t7-,8-,9-,11+/m1/s1
• InChIKey: AJTGLNPDCYGTAW-CDLYGTGVSA-N

Properties

• Density: 1.097g/cm³ (Cal.)
• Boiling point: 359.859°C at 760 mmHg (Cal.)
• Flash point: 156.396°C (Cal.)
• Refractive index: 1.49 (Cal.)