IUPAC Name :2-[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]acetonitrile
InChI :InChI=1/C14H17NO5/c1-8-11(16)12(17)13(18)14(19-8)20-10-4-2-9(3-5-10)6-7-15/h2-5,8,11-14,16-18H,6H2,1H3/t8-,11-,12+,13+,14-/m0/s1
Std.InChI: InChI=1S/C14H17NO5/c1-8-11(16)12(17)13(18)14(19-8)20-10-4-2-9(3-5-10)6-7-15/h2-5,8,11-14,16-18H,6H2,1H3/t8-,11-,12+,13+,14-/m0/s1
InChIKey :OBJREHLZEIEGDU-CNJBRALLBR
Std.InChIKey: OBJREHLZEIEGDU-CNJBRALLSA-N
SMILES :C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=CC=C(C=C2)CC#N)O)O)O
Molar Refractivity :69.90 ± 0.3 cm3 (est)
Parachor :560.3 ± 4.0 cm3 (est)
Index of Refraction :1.600 ± 0.02
(est)
Surface Tension :56.7 ± 3.0 dyne/cm (est)
Density :1.368 ± 0.06 g/cm3 (est)
Polarizability :27.71 ± 0.5 10-24cm3 (est)