3870-47-1
3,3',3'',3'''-TETRAKIS(TRIFLUOROMETHYL)BENZOPINACOLE
Name3,3',3'',3'''-TETRAKIS(TRIFLUOROMETHYL)BENZOPINACOLE
1Identification
【Name】
3,3',3'',3'''-TETRAKIS(TRIFLUOROMETHYL)BENZOPINACOLE
【CAS】
【MDL】
MFCD00074847
【English Synonyms】
【Formula】
C30 H18 F12 O2
【MolWeight】
638.446
【Inchi】
InChI=1S/C30H18F12O2/c31-27(32,33)21-9-1-5-17(13-21)25(43,18-6-2-10-22(14-18)28(34,35)36)26(44,19-7-3-11-23(15-19)29(37,38)39)20-8-4-12-24(16-20)30(40,41)42/h1-16,43-44H
【InChIKey】
InChIKey=UHKNZEHXAJSNBP-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)C(F)(F)F)C(c2cccc(c2)C(F)(F)F)(C(c3cccc(c3)C(F)(F)F)(c4cccc(c4)C(F)(F)F)O)O
【MOL File】
3,3',3'',3'''-TETRAK….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:2
XLogP3:9.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,3',3'',3'''-TETRAKIS(TRIFLUOROMETHYL)BENZOPINACOLE.cml