[1,1'-Biphenyl]-4-aceticacid, 2-fluoro-a-methyl-,(aR)- (51543-40-9)

The (R)-2-Flurbiprofen with the CAS number 51543-40-9 is also called [1,1'-Biphenyl]-4-aceticacid, 2-fluoro-a-methyl-,(aR)-. The IUPAC name is (2R)-2-(3-fluoro-4-phenylphenyl)propanoic acid. Its molecular formula is C₁₅H₁₃FO₂. The EINECS registry number is 257-264-7.

The properties of the (R)-2-Flurbiprofen are: (1)ACD/LogP: 4.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.74; (4)ACD/LogD (pH 7.4): 0.98; (5)ACD/BCF (pH 5.5): 33.34; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 174.19; (8)ACD/KOC (pH 7.4): 3.01; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.567; (14)Molar Refractivity: 66.58 cm³; (15)Molar Volume: 203.6 cm³; (16)Polarizability: 26.39×10^-24cm³; (17)Surface Tension: 44 dyne/cm; (18)Enthalpy of Vaporization: 65.81 kJ/mol; (19)Vapour Pressure: 2.5×10^-6 mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is toxic if swallowed. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing, gloves and eye/face protection. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Finally in case of accident or if you feel unwell, you should seek medical advice immediately (show the label whenever possible).

You can still convert the following datas into molecular structure:
(1)SMILES: Fc2cc(ccc2c1ccccc1)[C@H](C(=O)O)C
(2)InChI: InChI=1/C15H13FO2/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11/h2-10H,1H3,(H,17,18)/t10-/m1/s1
(3)InChIKey: SYTBZMRGLBWNTM-SNVBAGLBBP