floral nitrile
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IUPAC Name :3-(4-ethylphenyl)-2,2-dimethylpropanenitrile
InChI :InChI=1/C13H17N/c1-4-11-5-7-12(8-6-11)9-13(2,3)10-14/h5-8H,4,9H2,1-3H3
Std.InChI: InChI=1S/C13H17N/c1-4-11-5-7-12(8-6-11)9-13(2,3)10-14/h5-8H,4,9H2,1-3H3
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InChIKey :NWMCCMGWYCKNJR-UHFFFAOYAX
Std.InChIKey: NWMCCMGWYCKNJR-UHFFFAOYSA-N
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SMILES :CCC1=CC=C(C=C1)CC(C)(C)C#N
Molar Refractivity :59.12 ± 0.3 cm3 (est)
Parachor :483.2 ± 4.0 cm3 (est)
Index of Refraction :1.509 ± 0.02 (est)
Surface Tension :35.4 ± 3.0 dyne/cm (est)
Density :0.945 ± 0.06 g/cm3 (est)
Polarizability :23.44 ± 0.5 10-24cm3 (est)