1-Phenyl-2-[(1S,3R)-2,2,3-trimethylcyclopentyl]ethanone
[CAS# 791104-81-9]

Identification

• Name: 1-Phenyl-2-[(1S,3R)-2,2,3-trimethylcyclopentyl]ethanone
• Synonyms: 1-phenyl-2-((1S,3R)-2,2,3-trimethylcyclopentyl)ethanone
• Molecular Formula: C₁₆H₂₂O
• Molecular Weight: 230.35
• CAS Registry Number: 791104-81-9
• SMILES: C[C@@H]1CC[C@H](C1(C)C)CC(=O)c2ccccc2
• InChI: 1S/C16H22O/c1-12-9-10-14(16(12,2)3)11-15(17)13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3/t12-,14+/m1/s1
• InChIKey: NMQXPIOUXDEACS-OCCSQVGLSA-N

Properties

• Density: 0.944g/cm³ (Cal.)
• Boiling point: 315.39°C at 760 mmHg (Cal.)
• Flash point: 130.241°C (Cal.)
• Refractive index: 1.497 (Cal.)