321998-08-7
2-(1,3-DIMETHYL-4-NITRO-1H-PYRAZOL-5-YL)ACETALDEHYDE O-METHYLOXIME
Name2-(1,3-DIMETHYL-4-NITRO-1H-PYRAZOL-5-YL)ACETALDEHYDE O-METHYLOXIME
1Identification
【Name】
2-(1,3-DIMETHYL-4-NITRO-1H-PYRAZOL-5-YL)ACETALDEHYDE O-METHYLOXIME
【CAS】
【MDL】
MFCD00173115
【English Synonyms】
【Formula】
C8 H12 N4 O3
【MolWeight】
212.208
【Inchi】
InChI=1S/C8H12N4O3/c1-6-8(12(13)14)7(11(2)10-6)4-5-9-15-3/h5H,4H2,1-3H3/b9-5+
【InChIKey】
InChIKey=FXKQWKRCBYAHAC-WEVVVXLNSA-N
【SMILES】
Cc1c(c(n(n1)C)C/C=N/OC)[N+](=O)[O-]
【MOL File】
2-(1,3-DIMETHYL-4-NI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(1,3-DIMETHYL-4-NITRO-1H-PYRAZOL-5-YL)ACETALDEHYDE O-METHYLOXIME.cml