assafoetidin

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IUPAC Name :7-[(Z)-5-(5-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3-methylpent-2-enoxy]chromen-2-one
InChI :InChI=1/C24H30O4/c1-16(5-10-20-17(2)6-11-22(25)24(20,3)4)13-14-27-19-9-7-18-8-12-23(26)28-21(18)15-19/h7-9,12-13,15,22,25H,5-6,10-11,14H2,1-4H3/b16-13-
Std.InChI: InChI=1S/C24H30O4/c1-16(5-10-20-17(2)6-11-22(25)24(20,3)4)13-14-27-19-9-7-18-8-12-23(26)28-21(18)15-19/h7-9,12-13,15,22,25H,5-6,10-11,14H2,1-4H3/b16-13-
InChIKey :FDKWXRYTMNZMOF-SSZFMOIBBB
Std.InChIKey: FDKWXRYTMNZMOF-SSZFMOIBSA-N
SMILES :CC1=C(C(C(CC1)O)(C)C)CC/C(=C\COC2=CC3=C(C=C2)C=CC(=O)O3)/C
Molar Refractivity :110.40 ± 0.3 cm3 (est)
Parachor :871.0 ± 6.0 cm3 (est)
Index of Refraction :1.554 ± 0.02 (est)
Surface Tension :41.0 ± 3.0 dyne/cm (est)
Density :1.111 ± 0.06 g/cm3 (est)
Polarizability :43.76 ± 0.5 10-24cm3 (est)