IUPAC Name : [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-(hydroxymethyl)phenoxy]oxan-2-yl]methyl benzoate
InChI :InChI=1/C20H22O8/c21-10-13-8-4-5-9-14(13)27-20-18(24)17(23)16(22)15(28-20)11-26-19(25)12-6-2-1-3-7-12/h1-9,15-18,20-24H,10-11H2/t15-,16-,17+,18-,20-/m1/s1
Std.InChI: InChI=1S/C20H22O8/c21-10-13-8-4-5-9-14(13)27-20-18(24)17(23)16(22)15(28-20)11-26-19(25)12-6-2-1-3-7-12/h1-9,15-18,20-24H,10-11H2/t15-,16-,17+,18-,20-/m1/s1
InChIKey :HHSKNLJWHGXWPK-BFMVXSJEBZ
Std.InChIKey: HHSKNLJWHGXWPK-BFMVXSJESA-N
SMILES :C1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=CC=CC=C3CO)O)O)O
Molar Refractivity :98.22 ± 0.3 cm3 (est)
Parachor :774.1 ± 4.0 cm3 (est)
Index of Refraction :1.632 ± 0.02
(est)
Surface Tension :62.7 ± 3.0 dyne/cm (est)
Density :1.419 ± 0.06 g/cm3 (est)
Polarizability :38.93 ± 0.5 10-24cm3 (est)