898766-08-0
2,2-DIMETHYL-3',4',5'-TRIFLUOROBUTYROPHENONE
Name2,2-DIMETHYL-3',4',5'-TRIFLUOROBUTYROPHENONE
1Identification
【Name】
2,2-DIMETHYL-3',4',5'-TRIFLUOROBUTYROPHENONE
【CAS】
【MDL】
MFCD03841162
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C12 H13 F3 O
【pro_molWeight】
230.228
【Inchi】
InChI=1S/C12H13F3O/c1-4-12(2,3)11(16)7-5-8(13)10(15)9(14)6-7/h5-6H,4H2,1-3H3
【InChIKey】
InChIKey=WLYVMDXNYLZOPQ-UHFFFAOYSA-N
【SMILES】
CCC(C)(C)C(=O)c1cc(c(c(c1)F)F)F
【MOL File】
2,2-DIMETHYL-3',4',5….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:1
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2,2-DIMETHYL-3',4',5'-TRIFLUOROBUTYROPHENONE.cml