560132-48-1
6-METHYL-4-(TRIFLUOROMETHYL)PYRIDAZIN-3(2H)-ONE
Name6-METHYL-4-(TRIFLUOROMETHYL)PYRIDAZIN-3(2H)-ONE
1Identification
【Name】
6-METHYL-4-(TRIFLUOROMETHYL)PYRIDAZIN-3(2H)-ONE
【CAS】
【MDL】
MFCD09040417
【English Synonyms】
【Formula】
C6 H5 F3 N2 O
【MolWeight】
178.113
【Inchi】
InChI=1S/C6H5F3N2O/c1-3-2-4(6(7,8)9)5(12)11-10-3/h2H,1H3,(H,11,12)
【InChIKey】
InChIKey=ZLPLEWTVXFKICX-UHFFFAOYSA-N
【SMILES】
Cc1cc(c(=O)[nH]n1)C(F)(F)F
【MOL File】
6-METHYL-4-(TRIFLUOR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-METHYL-4-(TRIFLUOROMETHYL)PYRIDAZIN-3(2H)-ONE.cml