59199-14-3
1-(4-CHLOROPHENYL)-N-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-3-CARBOXAMIDE
Name1-(4-CHLOROPHENYL)-N-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-3-CARBOXAMIDE
1Identification
【Name】
1-(4-CHLOROPHENYL)-N-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-3-CARBOXAMIDE
【CAS】
【MDL】
MFCD20229202
【English Synonyms】
【Formula】
C11 H10 Cl N3 O2
【MolWeight】
251.672
【Inchi】
InChI=1S/C11H10ClN3O2/c1-13-11(17)9-6-10(16)15(14-9)8-4-2-7(12)3-5-8/h2-5H,6H2,1H3,(H,13,17)
【InChIKey】
InChIKey=OAGNCVVYFYEOBL-UHFFFAOYSA-N
【SMILES】
CNC(=O)C1=NN(C(=O)C1)c2ccc(cc2)Cl
【MOL File】
1-(4-CHLOROPHENYL)-N….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(4-CHLOROPHENYL)-N-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-3-CARBOXAMIDE.cml