857352-43-3
METHANONE, (4-METHYL-1H-IMIDAZOL-5-YL)NITRO-, OXIME
NameMETHANONE, (4-METHYL-1H-IMIDAZOL-5-YL)NITRO-, OXIME
1Identification
【Name】
METHANONE, (4-METHYL-1H-IMIDAZOL-5-YL)NITRO-, OXIME
【CAS】
【MDL】
MFCD16878241
【English Synonyms】
【Formula】
C5 H6 N4 O3
【MolWeight】
170.127
【Inchi】
InChI=1S/C5H6N4O3/c1-3-4(7-2-6-3)5(8-10)9(11)12/h2,10H,1H3,(H,6,7)/b8-5+
【InChIKey】
InChIKey=KRQJYEXCWPZBDO-VMPITWQZSA-N
【SMILES】
Cc1c([nH]cn1)/C(=N\O)/[N+](=O)[O-]
【MOL File】
METHANONE, (4-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:-2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METHANONE, (4-METHYL-1H-IMIDAZOL-5-YL)NITRO-, OXIME.cml