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2-(9-(pyridin-2-yl)-6-oxaspiro[4.5]decan-9-yl)acetonitrile
化学名:2-(9-(pyridin-2-yl)-6-oxaspiro[4.5]decan-9-yl)acetonitrile
CAS番号.1401031-37-5
英語名:2-(9-(pyridin-2-yl)-6-oxaspiro[4.5]decan-9-yl)acetonitrile
CBNumberCB03142590
MFC16H20N2O
MW256.34
MOL File1401031-37-5.mol
2-(9-(pyridin-2-yl)-6-oxaspiro[4.5]decan-9-yl)acetonitrile物理性質
沸点 | 445.3±25.0 °C(Predicted) |
比重(密度) | 1.13±0.1 g/cm3(Predicted) |
酸解離定数(Pka) | 5.41±0.19(Predicted) |
InChI | InChI=1S/C16H20N2O/c17-10-8-15(14-5-1-4-11-18-14)9-12-19-16(13-15)6-2-3-7-16/h1,4-5,11H,2-3,6-9,12-13H2 |
InChIKey | AJVYDBCIZBRGAK-UHFFFAOYSA-N |
SMILES | C1C2(CC(C3=NC=CC=C3)(CC#N)CCO2)CCC1 |