14026-46-1
1-(3,4-DIHYDRO-6-NITROQUINOLIN-1(2H)-YL)ETHANONE
Name1-(3,4-DIHYDRO-6-NITROQUINOLIN-1(2H)-YL)ETHANONE
1Identification
【Name】
1-(3,4-DIHYDRO-6-NITROQUINOLIN-1(2H)-YL)ETHANONE
【CAS】
【MDL】
MFCD01463983
【English Synonyms】
【Formula】
C11 H12 N2 O3
【MolWeight】
220.227
【Inchi】
InChI=1S/C11H12N2O3/c1-8(14)12-6-2-3-9-7-10(13(15)16)4-5-11(9)12/h4-5,7H,2-3,6H2,1H3
【InChIKey】
InChIKey=XXIBEYUXYNJBKQ-UHFFFAOYSA-N
【SMILES】
CC(=O)N1CCCc2c1ccc(c2)[N+](=O)[O-]
【MOL File】
1-(3,4-DIHYDRO-6-NIT….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(3,4-DIHYDRO-6-NITROQUINOLIN-1(2H)-YL)ETHANONE.cml