(1R,2R,3S,4S,5R)-3-(Hydroxymethyl)tricyclo[3.2.1.0^2,4]octan-6-one
[CAS# 802911-82-6]

Identification

• Name: (1R,2R,3S,4S,5R)-3-(Hydroxymethyl)tricyclo[3.2.1.0^2,4]octan-6-one
• Synonyms: (1R,2R,3S,4S,5R)-3-(hydroxymethyl)tricyclo[3.2.1.02,4]octan-6-one
• Molecular Formula: C₉H₁₂O₂
• Molecular Weight: 152.19
• CAS Registry Number: 802911-82-6
• SMILES: C1[C@@H]2CC(=O)[C@H]1[C@H]3[C@@H]2[C@@H]3CO
• InChI: 1S/C9H12O2/c10-3-6-8-4-1-5(9(6)8)7(11)2-4/h4-6,8-10H,1-3H2/t4-,5+,6+,8+,9-/m1/s1
• InChIKey: NOYXPYMXFRHUHU-UEPDZIIQSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 288.0±13.0°C at 760 mmHg (Cal.)
• Flash point: 121.0±12.4°C (Cal.)
• Refractive index: 1.575 (Cal.)