The [2,2'-Bithiophene]-5-methanol, with CAS registry number 3515-30-8, has the systematic name of 2,2'-bithiophen-5-ylmethanol. Besides this, it is also called 5-(Hydroxymethyl)-[2,2']-bithiophene. And the chemical formula of this chemical is C9H8OS2. When use this chemical, avoid contact with skin and eyes.
Physical properties of [2,2'-Bithiophene]-5-methanol: (1)ACD/LogP: 2.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.4; (4)ACD/LogD (pH 7.4): 2.4; (5)ACD/BCF (pH 5.5): 39.36; (6)ACD/BCF (pH 7.4): 39.36; (7)ACD/KOC (pH 5.5): 482.32; (8)ACD/KOC (pH 7.4): 482.32; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 65.71 Å2; (13)Index of Refraction: 1.654; (14)Molar Refractivity: 54.06 cm3; (15)Molar Volume: 147.4 cm3; (16)Polarizability: 21.43×10-24cm3; (17)Surface Tension: 54.3 dyne/cm; (18)Density: 1.33 g/cm3; (19)Flash Point: 151.7 °C; (20)Enthalpy of Vaporization: 60.11 kJ/mol; (21)Boiling Point: 327.2 °C at 760 mmHg; (22)Vapour Pressure: 8.32E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: s2c(c1sc(cc1)CO)ccc2
(2)InChI: InChI=1/C9H8OS2/c10-6-7-3-4-9(12-7)8-2-1-5-11-8/h1-5,10H,6H2
(3)InChIKey: PUWTXRUXHPHFSQ-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C9H8OS2/c10-6-7-3-4-9(12-7)8-2-1-5-11-8/h1-5,10H,6H2
(5)Std. InChIKey: PUWTXRUXHPHFSQ-UHFFFAOYSA-N
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