247170-28-1
1-ACETYL-3,5-BIS(NONAFLUORO-1-BUTYL)PYRAZOLE
Name1-ACETYL-3,5-BIS(NONAFLUORO-1-BUTYL)PYRAZOLE
pro_formulaC13 H4 F18 N2 O
1Identification
【Name】
1-ACETYL-3,5-BIS(NONAFLUORO-1-BUTYL)PYRAZOLE
【CAS】
【MDL】
MFCD00153612
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C13 H4 F18 N2 O
【pro_molWeight】
546.152
【Inchi】
InChI=1S/C13H4F18N2O/c1-3(34)33-5(7(16,17)9(20,21)11(24,25)13(29,30)31)2-4(32-33)6(14,15)8(18,19)10(22,23)12(26,27)28/h2H,1H3
【InChIKey】
InChIKey=LFLWTZBRQAFGQE-UHFFFAOYSA-N
【SMILES】
CC(=O)n1c(cc(n1)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
【MOL File】
1-ACETYL-3,5-BIS(NON….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:8.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-ACETYL-3,5-BIS(NONAFLUORO-1-BUTYL)PYRAZOLE.cml