IUPAC Name :2-bromo-4-[3-(3-bromo-4-hydroxy-2-methyl-5-propan-2-ylphenyl)-1,1-dioxo-2,1?6-benzoxathiol-3-yl]-3-methyl-6-propan-2-ylphenol
InChI :InChI=1/C27H28Br2O5S/c1-13(2)17-11-20(15(5)23(28)25(17)30)27(19-9-7-8-10-22(19)35(32,33)34-27)21-12-18(14(3)4)26(31)24(29)16(21)6/h7-14,30-31H,1-6H3
Std.InChI: InChI=1S/C27H28Br2O5S/c1-13(2)17-11-20(15(5)23(28)25(17)30)27(19-9-7-8-10-22(19)35(32,33)34-27)21-12-18(14(3)4)26(31)24(29)16(21)6/h7-14,30-31H,1-6H3
InChIKey :NUHCTOLBWMJMLX-UHFFFAOYAD
Std.InChIKey: NUHCTOLBWMJMLX-UHFFFAOYSA-N
SMILES :CC1=C(C=C(C(=C1Br)O)C(C)C)C2(C3=CC=CC=C3S(=O)(=O)O2)C4=C(C(=C(C(=C4)C(C)C)O)Br)C
MDL: MFCD00005872
Molar Refractivity :144.79 ± 0.4 cm3 (est)
Parachor :1098.1 ± 4.0 cm3 (est)
Index of Refraction :1.634 ± 0.02
(est)
Surface Tension :54.1 ± 3.0 dyne/cm (est)
Density :1.542 ± 0.06 g/cm3 (est)
Polarizability :57.40 ± 0.5 10-24cm3 (est)