4-[(1R)-2,2-Difluoro-1-Hydroxy-3-Buten-1-Yl]Benzonitrile
[CAS# 505068-89-3]

Identification

• Name: 4-[(1R)-2,2-Difluoro-1-Hydroxy-3-Buten-1-Yl]Benzonitrile
• Synonyms: (R)-4-(2,2-difluoro-1-hydroxybut-3-en-1-yl)benzonitrile
• Molecular Formula: C₁₁H₉F₂NO
• Molecular Weight: 209.19
• CAS Registry Number: 505068-89-3
• SMILES: C=CC([C@@H](c1ccc(cc1)C#N)O)(F)F
• InChI: 1S/C11H9F2NO/c1-2-11(12,13)10(15)9-5-3-8(7-14)4-6-9/h2-6,10,15H,1H2/t10-/m1/s1
• InChIKey: BMOULFUXLWZTBC-SNVBAGLBSA-N

Properties

• Density: 1.231g/cm³ (Cal.)
• Boiling point: 362.006°C at 760 mmHg (Cal.)
• Flash point: 172.735°C (Cal.)
• Refractive index: 1.517 (Cal.)