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CAS No.: | 147497-56-1 |
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Name: | (4'-FLUOROBIPHENYL-4-YL)-METHANOL |
Article Data: | 13 |
Molecular Structure: | |
Formula: | C13H11FO |
Molecular Weight: | 202.228 |
Synonyms: | (4-FLUORO[1,1-BIPHENYL]-4-YL)METHANOL;(4-FLUOROBIPHENYL-4-YL)-METHANOL;[4-(4-FLUOROPHENYL)PHENYL]METHAN-1-OL;AKOS BAR-1785;RARECHEM AL BD 1240;4-(4-Fluorophenyl)Benzyl Alcohol;4-Fluoro-[1,1-biphenyl]-4-Methanol |
Density: | 1.17 g/cm3 |
Boiling Point: | 337.3 °C at 760 mmHg |
Flash Point: | 190.4 °C |
PSA: | 20.23000 |
LogP: | 2.98500 |
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This chemical is called (4'-Fluorobiphenyl-4-yl)methanol, and it can also be named as [1,1'-Biphenyl]-4-methanol, 4'-fluoro-. With the molecular formula of C13H11FO, its molecular weight is 202.22. The CAS registry number of this chemical is 147497-56-1.
Other characteristics of the (4'-Fluorobiphenyl-4-yl)methanol can be summarised as followings: (1)ACD/LogP: 2.73; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.73; (4)ACD/LogD (pH 7.4): 2.73; (5)ACD/BCF (pH 5.5): 69.42; (6)ACD/BCF (pH 7.4): 69.42; (7)ACD/KOC (pH 5.5): 724.04; (8)ACD/KOC (pH 7.4): 724.04; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.577; (14)Molar Refractivity: 57.28 cm3; (15)Molar Volume: 172.7 cm3; (16)Polarizability: 22.71×10-24cm3; (17)Surface Tension: 42.5 dyne/cm; (18)Density: 1.17 g/cm3; (19)Flash Point: 190.4 °C; (20)Enthalpy of Vaporization: 61.28 kJ/mol; (21)Boiling Point: 337.3 °C at 760 mmHg; (22)Vapour Pressure: 4.13E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Fc2ccc(c1ccc(cc1)CO)cc2
2.InChI: InChI=1/C13H11FO/c14-13-7-5-12(6-8-13)11-3-1-10(9-15)2-4-11/h1-8,15H,9H2
3.InChIKey: ZSWIVXLMMVNSCM-UHFFFAOYAF