2H-1,5-benzodioxepin-3(4H)-one, 7-(1,1-dimethylethyl)-

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IUPAC Name :7-tert-butyl-1,5-benzodioxepin-3-one
InChI :InChI=1/C13H16O3/c1-13(2,3)9-4-5-11-12(6-9)16-8-10(14)7-15-11/h4-6H,7-8H2,1-3H3
Std.InChI: InChI=1S/C13H16O3/c1-13(2,3)9-4-5-11-12(6-9)16-8-10(14)7-15-11/h4-6H,7-8H2,1-3H3
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InChIKey :VFQHMVHBTUURKJ-UHFFFAOYAE
Std.InChIKey: VFQHMVHBTUURKJ-UHFFFAOYSA-N
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SMILES :CC(C)(C)c1cc2OCC(=O)COc2cc1
Molar Refractivity :60.15 ± 0.3 cm3 (est)
Parachor :493.1 ± 6.0 cm3 (est)
Index of Refraction :1.515 ± 0.02 (est)
Surface Tension :37.5 ± 3.0 dyne/cm (est)
Density :1.105 ± 0.06 g/cm3 (est)
Polarizability :23.84 ± 0.5 10-24cm3 (est)