1116229-11-8
1-(4-(3-methoxy-4-nitrophenyl)piperazin-1-yl)ethanone
Name1-(4-(3-methoxy-4-nitrophenyl)piperazin-1-yl)ethanone
1Identification
【Name】
1-(4-(3-methoxy-4-nitrophenyl)piperazin-1-yl)ethanone
【CAS】
【MDL】
【English Synonyms】
【Formula】
C13H17N3O4
【MolWeight】
279.2918
【Inchi】
InChI=1S/C13H17N3O4/c1-10(17)14-5-7-15(8-6-14)11-3-4-12(16(18)19)13(9-11)20-2/h3-4,9H,5-8H2,1-2H3
【InChIKey】
InChIKey=GUTDYFMBYFDQBU-UHFFFAOYSA-N
【SMILES】
COC=1C=C(C=CC1[N+](=O)[O-])N1CCN(CC1)C(C)=O
【MOL File】
1-(4-(3-methoxy-4-ni….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
1-(4-(3-methoxy-4-nitrophenyl)piperazin-1-yl)ethanone.cml