2-Deoxy-2-Fluoroinositol
[CAS# 116049-87-7]

Identification

• Name: 2-Deoxy-2-Fluoroinositol
• Synonyms: Dl-Epi-Inositol, 2-Deoxy-2-Fluoro-; 2-Deoxy-2-Fluoro-Myo-Inositol; 2-Deoxy-2-Fluoroinositol
• Molecular Formula: C₆H₁₁FO₅
• Molecular Weight: 182.15
• CAS Registry Number: 116049-87-7
• SMILES: [C@H]1(O)C(O)[C@H](O)[C@@H](O)C(F)[C@H]1O
• InChI: 1S/C6H11FO5/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6,8-12H/t1?,2-,3+,4-,5-,6?/m1/s1
• InChIKey: PDTJJYSBSOKEOY-GCVPSNMTSA-N

Properties

• Density: 1.714g/cm³ (Cal.)
• Boiling point: 304.749°C at 760 mmHg (Cal.)
• Flash point: 138.108°C (Cal.)