IUPAC Name :propan-2-yl (Z)-7-[(1R,2R,3R,5S)-2-[(E)-3,3-difluoro-4-phenoxybut-1-enyl]-3,5-dihydroxycyclopentyl]hept-5-enoate
InChI :InChI=1/C25H34F2O5/c1-18(2)32-24(30)13-9-4-3-8-12-20-21(23(29)16-22(20)28)14-15-25(26,27)17-31-19-10-6-5-7-11-19/h3,5-8,10-11,14-15,18,20-23,28-29H,4,9,12-13,16-17H2,1-2H3/b8-3-,15-14+/t20-,21-,22+,23-/m1/s1
Std.InChI: InChI=1S/C25H34F2O5/c1-18(2)32-24(30)13-9-4-3-8-12-20-21(23(29)16-22(20)28)14-15-25(26,27)17-31-19-10-6-5-7-11-19/h3,5-8,10-11,14-15,18,20-23,28-29H,4,9,12-13,16-17H2,1-2H3/b8-3-,15-14+/t20-,21-,22+,23-/m1/s1
InChIKey :WSNODXPBBALQOF-VEJSHDCNBL
Std.InChIKey: WSNODXPBBALQOF-VEJSHDCNSA-N
SMILES :CC(C)OC(=O)CCC/C=C\C[C@H]1[C@H](C[C@H]([C@@H]1/C=C/C(COC2=CC=CC=C2)(F)F)O)O
Molar Refractivity :121.34 ± 0.3 cm3 (est)
Parachor :964.0 ± 4.0 cm3 (est)
Index of Refraction :1.548 ± 0.02
(est)
Surface Tension :40.7 ± 3.0 dyne/cm (est)
Density :1.186 ± 0.06 g/cm3 (est)
Polarizability :48.10 ± 0.5 10-24cm3 (est)