2,6-Difluorophenol

The 2,6-Difluorophenol with CAS registry number of 28177-48-2 is also known as Phenol,2,6-difluoro-. The IUPAC name and product name are the same. It belongs to product categories of Fluoro-Aromatics; Aromatic Phenols; Fluorobenzene; Phenol&Thiophenol&Mercaptan; Fluorophenols; Organic Building Blocks; Oxygen Compounds; Phenols. Its EINECS registry number is 248-884-9. In addition, the formula is C₆H₄F₂O and the molecular weight is 130.09. This chemical is a white crystal and it is used for medicine, pesticide, liquid crystal intermediates.

Physical properties about 2,6-Difluorophenol are: (1)ACD/LogP: 1.98; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.97; (4)ACD/LogD (pH 7.4): 1.7; (5)ACD/BCF (pH 5.5): 18.48; (6)ACD/BCF (pH 7.4): 9.87; (7)ACD/KOC (pH 5.5): 279.82; (8)ACD/KOC (pH 7.4): 149.52; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.495; (13)Molar Refractivity: 28.12 cm³; (14)Molar Volume: 96.2 cm³; (15)Surface Tension: 36.4 dyne/cm; (16)Density: 1.351 g/cm³; (17)Flash Point: 58.9 °C; (18)Enthalpy of Vaporization: 41.06 kJ/mol; (19)Boiling Point: 157.7 °C at 760 mmHg; (20)Vapour Pressure: 2.11 mmHg at 25 °C.

When you are using this chemical, please be cautious about it. As a chemical, it is irritating to eyes, respiratory system and skin. Besides, it is highly flammable and also harmful by inhalation, in contact with skin and if swallowed. During using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: C1=CC(=C(C(=C1)F)O)F
2. InChI: InChI=1S/C6H4F2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H
3. InChIKey: CKKOVFGIBXCEIJ-UHFFFAOYSA-N