(3aS,7R,7aR)-7-Fluoro-2,2,7-trimethyl-7,7a-dihydro-1,3-benzodioxol-4(3aH)-one
[CAS# 738614-51-2]

Identification

• Name: (3aS,7R,7aR)-7-Fluoro-2,2,7-trimethyl-7,7a-dihydro-1,3-benzodioxol-4(3aH)-one
• Synonyms: (3aS,7R,7aR)-7-fluoro-2,2,7-trimethyl-7,7a-dihydrobenzo[d][1,3]dioxol-4(3aH)-one
• Molecular Formula: C₁₀H₁₃FO₃
• Molecular Weight: 200.21
• CAS Registry Number: 738614-51-2
• SMILES: C[C@]1(C=CC(=O)[C@@H]2[C@H]1OC(O2)(C)C)F
• InChI: 1S/C10H13FO3/c1-9(2)13-7-6(12)4-5-10(3,11)8(7)14-9/h4-5,7-8H,1-3H3/t7-,8-,10-/m1/s1
• InChIKey: YZCVSTNGJHRUTC-NQMVMOMDSA-N

Properties

• Density: 1.201g/cm³ (Cal.)
• Boiling point: 260.691°C at 760 mmHg (Cal.)
• Flash point: 108.169°C (Cal.)
• Refractive index: 1.486 (Cal.)