135525-71-2
3-(2-(BENZOXAZOL-2-YL)ETHYL)-5-ETHYL-6-METHYLPYRIDIN-2(1H)-ONE
Name3-(2-(BENZOXAZOL-2-YL)ETHYL)-5-ETHYL-6-METHYLPYRIDIN-2(1H)-ONE
1Identification
【Name】
3-(2-(BENZOXAZOL-2-YL)ETHYL)-5-ETHYL-6-METHYLPYRIDIN-2(1H)-ONE
【CAS】
【MDL】
MFCD00869721
【English Synonyms】
【Formula】
C17 H18 N2 O2
【MolWeight】
282.341
【Inchi】
InChI=1S/C17H18N2O2/c1-3-12-10-13(17(20)18-11(12)2)8-9-16-19-14-6-4-5-7-15(14)21-16/h4-7,10H,3,8-9H2,1-2H3,(H,18,20)
【InChIKey】
InChIKey=MHUVLRNBDLFMHQ-UHFFFAOYSA-N
【SMILES】
CCc1cc(c(=O)[nH]c1C)CCc2nc3ccccc3o2
【MOL File】
3-(2-(BENZOXAZOL-2-Y….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(2-(BENZOXAZOL-2-YL)ETHYL)-5-ETHYL-6-METHYLPYRIDIN-2(1H)-ONE.cml