845823-08-7
3',5'-DIMETHYL-4'-METHOXY-2,2,2-TRIFLUOROACETOPHENONE
Name3',5'-DIMETHYL-4'-METHOXY-2,2,2-TRIFLUOROACETOPHENONE
1Identification
【Name】
3',5'-DIMETHYL-4'-METHOXY-2,2,2-TRIFLUOROACETOPHENONE
【CAS】
【MDL】
MFCD06201803
【English Synonyms】
【Formula】
C11 H11 F3 O2
【MolWeight】
232.2
【Inchi】
InChI=1S/C11H11F3O2/c1-6-4-8(10(15)11(12,13)14)5-7(2)9(6)16-3/h4-5H,1-3H3
【InChIKey】
InChIKey=TUZULLSDLGAQMV-UHFFFAOYSA-N
【SMILES】
Cc1cc(cc(c1OC)C)C(=O)C(F)(F)F
【MOL File】
3',5'-DIMETHYL-4'-ME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
3',5'-DIMETHYL-4'-METHOXY-2,2,2-TRIFLUOROACETOPHENONE.cml