benzyl 2-methyl butyrate
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IUPAC Name :benzyl 2-methylbutanoate
InChI :InChI=1/C12H16O2/c1-3-10(2)12(13)14-9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3
Std.InChI: InChI=1S/C12H16O2/c1-3-10(2)12(13)14-9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3
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InChIKey :PTKDIBUNVYIPOD-UHFFFAOYAL
Std.InChIKey: PTKDIBUNVYIPOD-UHFFFAOYSA-N
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SMILES :CCC(C)C(=O)OCC1=CC=CC=C1
Molar Refractivity :56.06 ± 0.3 cm3 (est)
Parachor :465.1 ± 4.0 cm3 (est)
Index of Refraction :1.495 ± 0.02 (est)
Surface Tension :34.3 ± 3.0 dyne/cm (est)
Density :1.000 ± 0.06 g/cm3 (est)
Polarizability :22.22 ± 0.5 10-24cm3 (est)