3-octyl tiglate
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IUPAC Name :octan-3-yl 2-methylbut-2-enoate
InChI :InChI=1/C13H24O2/c1-5-8-9-10-12(7-3)15-13(14)11(4)6-2/h6,12H,5,7-10H2,1-4H3
Std.InChI: InChI=1S/C13H24O2/c1-5-8-9-10-12(7-3)15-13(14)11(4)6-2/h6,12H,5,7-10H2,1-4H3
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InChIKey :LMBAQNNBRWRROG-UHFFFAOYAP
Std.InChIKey: LMBAQNNBRWRROG-UHFFFAOYSA-N
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SMILES :CCCCCC(CC)OC(=O)C(=CC)C
MDL: MFCD00016641
Molar Refractivity :63.91 ± 0.3 cm3 (est)
Parachor :554.8 ± 4.0 cm3 (est)
Index of Refraction :1.444 ± 0.02 (est)
Surface Tension :28.3 ± 3.0 dyne/cm (est)
Density :0.883 ± 0.06 g/cm3 (est)
Polarizability :25.33 ± 0.5 10-24cm3 (est)