862588-66-7
2,4-DIHYDRO-2-METHYL-5-[4-(TRIFLUOROMETHYL)PHENYL]-3H-PYRAZOL-3-ONE
Name2,4-DIHYDRO-2-METHYL-5-[4-(TRIFLUOROMETHYL)PHENYL]-3H-PYRAZOL-3-ONE
1Identification
【Name】
2,4-DIHYDRO-2-METHYL-5-[4-(TRIFLUOROMETHYL)PHENYL]-3H-PYRAZOL-3-ONE
【CAS】
【MDL】
MFCD09749456
【English Synonyms】
【Formula】
C11 H9 F3 N2 O
【MolWeight】
242.199
【Inchi】
InChI=1S/C11H9F3N2O/c1-16-10(17)6-9(15-16)7-2-4-8(5-3-7)11(12,13)14/h2-5H,6H2,1H3
【InChIKey】
InChIKey=IVXCLCRHPNLQDU-UHFFFAOYSA-N
【SMILES】
CN1C(=O)CC(=N1)c2ccc(cc2)C(F)(F)F
【MOL File】
2,4-DIHYDRO-2-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,4-DIHYDRO-2-METHYL-5-[4-(TRIFLUOROMETHYL)PHENYL]-3H-PYRAZOL-3-ONE.cml