121716-35-6
ETHYL 5-CHLORO-1-(2-NITROPHENYL)-1H-PYRAZOLE-4-CARBOXYLATE
NameETHYL 5-CHLORO-1-(2-NITROPHENYL)-1H-PYRAZOLE-4-CARBOXYLATE
1Identification
【Name】
ETHYL 5-CHLORO-1-(2-NITROPHENYL)-1H-PYRAZOLE-4-CARBOXYLATE
【CAS】
【MDL】
MFCD17206167
【English Synonyms】
【Formula】
C12 H10 Cl N3 O4
【MolWeight】
295.681
【Inchi】
InChI=1S/C12H10ClN3O4/c1-2-20-12(17)8-7-14-15(11(8)13)9-5-3-4-6-10(9)16(18)19/h3-7H,2H2,1H3
【InChIKey】
InChIKey=XIHXVSUWUPYOLW-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1cnn(c1Cl)c2ccccc2[N+](=O)[O-]
【MOL File】
ETHYL 5-CHLORO-1-(2-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 5-CHLORO-1-(2-NITROPHENYL)-1H-PYRAZOLE-4-CARBOXYLATE.cml