The Benzenemethanol,2,2'-dithiobis-, with the CAS registry number 35190-71-7, is also known as 2,2'-Dithiodi(benzyl alcohol). This chemical's molecular formula is C14H14O2S2 and molecular weight is 278.39. What's more, its systematic name is (disulfanediyldibenzene-2,1-diyl)dimethanol.
Physical properties of Benzenemethanol,2,2'-dithiobis- are: (1)ACD/LogP: 2.04; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 7; (6)Polar Surface Area: 69.06 Å2; (7)Index of Refraction: 1.704; (8)Molar Refractivity: 79.8 cm3; (9)Molar Volume: 205.3 cm3; (10)Surface Tension: 69.4 dyne/cm; (11)Density: 1.35 g/cm3; (12)Flash Point: 218.9 °C; (13)Enthalpy of Vaporization: 74.82 kJ/mol; (14)Boiling Point: 451.1 °C at 760 mmHg; (15)Vapour Pressure: 6.35E-09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: S(Sc1ccccc1CO)c2ccccc2CO
(2)InChI: InChI=1S/C14H14O2S2/c15-9-11-5-1-3-7-13(11)17-18-14-8-4-2-6-12(14)10-16/h1-8,15-16H,9-10H2
(3)InChIKey: GBCUGUWBYDCGFX-UHFFFAOYSA-N
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