3-butyl hexahydrophthalide
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IUPAC Name :3-butyl-3a,4,5,6,7,7a-hexahydro-3H-2-benzofuran-1-one
InChI :InChI=1/C12H20O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h9-11H,2-8H2,1H3
Std.InChI: InChI=1S/C12H20O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h9-11H,2-8H2,1H3
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InChIKey :TZRMFZSOOVBPPN-UHFFFAOYAD
Std.InChIKey: TZRMFZSOOVBPPN-UHFFFAOYSA-N
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SMILES :CCCCC1C2CCCCC2C(=O)O1
Molar Refractivity :55.27 ± 0.3 cm3 (est)
Parachor :471.0 ± 6.0 cm3 (est)
Index of Refraction :1.468 ± 0.02 (est)
Surface Tension :31.5 ± 3.0 dyne/cm (est)
Density :0.987 ± 0.06 g/cm3 (est)
Polarizability :21.91 ± 0.5 10-24cm3 (est)