2,2'-thiobis[4-chloro-6-isopropyl-m-cresol]

The 2,2'-Thiobis[4-chloro-6-isopropyl-3-methylphenol] is an organic compound with the formula C₂₀H₂₄Cl₂O₂S. The systematic name of this chemical is 2,2'-sulfanediylbis[4-chloro-3-methyl-6-(1-methylethyl)phenol]. With the CAS registry number 64633-23-4, it is also named as phenol, 2,2'-thiobis[4-chloro-3-methyl-6-(1-methylethyl)-.

Physical properties about 2,2'-Thiobis[4-chloro-6-isopropyl-3-methylphenol] are: (1)ACD/LogP: 8.00; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.99; (4)ACD/LogD (pH 7.4): 7.96; (5)ACD/BCF (pH 5.5): 700837.44; (6)ACD/BCF (pH 7.4): 651386.06; (7)ACD/KOC (pH 5.5): 531795.56; (8)ACD/KOC (pH 7.4): 494271.88; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 43.76 Å²; (13)Index of Refraction: 1.621; (14)Molar Refractivity: 109.15 cm³; (15)Molar Volume: 310.1 cm³; (16)Polarizability: 43.27×10^-24cm³; (17)Surface Tension: 54.8 dyne/cm; (18)Density: 1.28 g/cm³; (19)Flash Point: 225.1 °C; (20)Enthalpy of Vaporization: 73.44 kJ/mol; (21)Boiling Point: 448.7 °C at 760 mmHg; (22)Vapour Pressure: 1.15E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc(c(O)c(Sc1c(c(Cl)cc(c1O)C(C)C)C)c2C)C(C)C
(2)InChI: InChI=1/C20H24Cl2O2S/c1-9(2)13-7-15(21)11(5)19(17(13)23)25-20-12(6)16(22)8-14(10(3)4)18(20)24/h7-10,23-24H,1-6H3
(3)InChIKey: AALDANJLYWODLY-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C20H24Cl2O2S/c1-9(2)13-7-15(21)11(5)19(17(13)23)25-20-12(6)16(22)8-14(10(3)4)18(20)24/h7-10,23-24H,1-6H3
(5)Std. InChIKey: AALDANJLYWODLY-UHFFFAOYSA-N