iriflorental

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InChI :InChI=1/C31H50O4/c1-22(12-15-27-23(2)13-14-25(4)29(27,5)6)10-8-17-31(21-34)28(11-9-19-32)26(24(3)20-33)16-18-30(31,7)35/h10,12,15,20,25,27-28,32,34-35H,2,8-9,11,13-14,16-19,21H2,1,3-7H3/b15-12+,22-10+,26-24-/t25-,27+,28+,30-,31+/m0/s1
Std.InChI: InChI=1S/C31H50O4/c1-22(12-15-27-23(2)13-14-25(4)29(27,5)6)10-8-17-31(21-34)28(11-9-19-32)26(24(3)20-33)16-18-30(31,7)35/h10,12,15,20,25,27-28,32,34-35H,2,8-9,11,13-14,16-19,21H2,1,3-7H3/b15-12+,22-10+,26-24-/t25-,27+,28+,30-,31+/m0/s1
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InChIKey :MBNLFFHRULJOPH-HLFHJSLSBH
Std.InChIKey: MBNLFFHRULJOPH-HLFHJSLSSA-N
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SMILES :C[C@H]1CCC(=C)[C@H](C1(C)C)/C=C/C(=C/CC[C@]2([C@@H](/C(=C(/C)\C=O)/CC[C@]2(C)O)CCCO)CO)/C
Molar Refractivity :144.99 ± 0.4 cm3 (est)
Parachor :1192.7 ± 6.0 cm3 (est)
Index of Refraction :1.536 ± 0.03 (est)
Surface Tension :43.4 ± 5.0 dyne/cm (est)
Density :1.04 ± 0.1 g/cm3 (est)
Polarizability :57.48 ± 0.5 10-24cm3 (est)