agrocybin

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IUPAC Name :8-hydroxyocta-2,4,6-triynamide
InChI :InChI=1/C8H5NO2/c9-8(11)6-4-2-1-3-5-7-10/h10H,7H2,(H2,9,11)
Std.InChI: InChI=1S/C8H5NO2/c9-8(11)6-4-2-1-3-5-7-10/h10H,7H2,(H2,9,11)
InChIKey :OXONWCQUZYDTNF-UHFFFAOYAK
Std.InChIKey: OXONWCQUZYDTNF-UHFFFAOYSA-N
SMILES :C(C#CC#CC#CC(=O)N)O
Molar Refractivity :43.03 ± 0.5 cm3 (est)
Parachor :381.7 ± 8.0 cm3 (est)
Index of Refraction :1.475 ± 0.05 (est)
Surface Tension :39.1 ± 7.0 dyne/cm (est)
Density :0.96 ± 0.1 g/cm3 (est)
Polarizability :17.05 ± 0.5 10-24cm3 (est)