14094-43-0
5-METHYL-4-NITROQUINOLINE-1-OXIDE
Name5-METHYL-4-NITROQUINOLINE-1-OXIDE
1Identification
【Name】
5-METHYL-4-NITROQUINOLINE-1-OXIDE
【CAS】
【MDL】
MFCD01685463
【English Synonyms】
【Formula】
C10 H8 N2 O3
【MolWeight】
204.184
【Inchi】
InChI=1S/C10H8N2O3/c1-7-3-2-4-8-10(7)9(12(14)15)5-6-11(8)13/h2-6H,1H3
【InChIKey】
InChIKey=WPQVMRHYELDDMA-UHFFFAOYSA-N
【SMILES】
Cc1cccc2c1c(cc[n+]2[O-])[N+](=O)[O-]
【MOL File】
5-METHYL-4-NITROQUIN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-METHYL-4-NITROQUINOLINE-1-OXIDE.cml