(1S,4S,5R)-4-Ethyl-1-(2-Fluorophenyl)-3-Oxabicyclo[3.1.0]Hexan-2-One
[CAS# 528588-17-2]

Identification

• Name: (1S,4S,5R)-4-Ethyl-1-(2-Fluorophenyl)-3-Oxabicyclo[3.1.0]Hexan-2-One
• Synonyms: (1S,4S,5R)-4-ethyl-1-(2-fluorophenyl)-3-oxabicyclo[3.1.0]hexan-2-one
• Molecular Formula: C₁₃H₁₃FO₂
• Molecular Weight: 220.24
• CAS Registry Number: 528588-17-2
• SMILES: CC[C@H]1[C@@H]2C[C@@]2(C(=O)O1)c3ccccc3F
• InChI: 1S/C13H13FO2/c1-2-11-9-7-13(9,12(15)16-11)8-5-3-4-6-10(8)14/h3-6,9,11H,2,7H2,1H3/t9-,11-,13+/m0/s1
• InChIKey: UCJQVQOJMILTQP-XHVZSJERSA-N

Properties

• Density: 1.253g/cm³ (Cal.)
• Boiling point: 353.274°C at 760 mmHg (Cal.)
• Flash point: 161.839°C (Cal.)
• Refractive index: 1.556 (Cal.)