144121-64-2
2,2-DIMETHYL-A,A,A',A'-TETRAKIS(2-NAPHTHYL)-1,3-DIOXOLANE-4,5-DIMETHANOLATOTITANIUM DIISOPROPOXIDE
Name2,2-DIMETHYL-A,A,A',A'-TETRAKIS(2-NAPHTHYL)-1,3-DIOXOLANE-4,5-DIMETHANOLATOTITANIUM DIISOPROPOXIDE
1Identification
【Name】
2,2-DIMETHYL-A,A,A',A'-TETRAKIS(2-NAPHTHYL)-1,3-DIOXOLANE-4,5-DIMETHANOLATOTITANIUM DIISOPROPOXIDE
【CAS】
【MDL】
MFCD16876620
【English Synonyms】
【Formula】
C53 H50 O6 Ti
【MolWeight】
830.839
【Inchi】
InChI=1S/C47H36O4.2C3H7O.Ti/c1-45(2)50-43(46(48,39-23-19-31-11-3-7-15-35(31)27-39)40-24-20-32-12-4-8-16-36(32)28-40)44(51-45)47(49,41-25-21-33-13-5-9-17-37(33)29-41)42-26-22-34-14-6-10-18-38(34)30-42;2*1-3(2)4;/h3-30,43-44H,1-2H3;2*3H,1-2H3;/q-2;2*-1;+4
【InChIKey】
InChIKey=DIFOSDSATKZFAC-UHFFFAOYSA-N
【SMILES】
CC(C)O[Ti]1(OC(C2C(C(O1)(c3ccc4ccccc4c3)c5ccc6ccccc6c5)OC(O2)(C)C)(c7ccc8ccccc8c7)c9ccc1ccccc1c9)OC(C)C
【MOL File】
2,2-DIMETHYL-A,A,A',….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:11.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,2-DIMETHYL-A,A,A',A'-TETRAKIS(2-NAPHTHYL)-1,3-DIOXOLANE-4,5-DIMETHANOLATOTITANIUM DIISOPROPOXIDE.cml