Synonyms
Ttmapp;69458-20-4;5,10,15,20-Tetrakis(4-trimethylammoniophenyl)porphyrin tetra(p-toluenesulfonate);MFCD00012023;Tetrakis(4-N-trimethylaminophenyl)porphine, tetra(p-toluenesulfonate) TTMAPP, purple powder;
IUPAC Name
4-methylbenzenesulfonate;trimethyl-[4-[10,15,20-tris[4-(trimethylazaniumyl)phenyl]-21,23-dihydroporphyrin-5-yl]phenyl]azanium;
Molecular Weight
1531.928g/mol
Molecular Formula
C84H90N8O12S4;
InChI
InChI=1S/C56H62N8.4C7H8O3S/c1-61(2,3)41-21-13-37(14-22-41)53-45-29-31-47(57-45)54(38-15-23-42(24-16-38)62(4,5)6)49-33-35-51(59-49)56(40-19-27-44(28-20-40)64(10,11)12)52-36-34-50(60-52)55(48-32-30-46(53)58-48)39-17-25-43(26-18-39)63(7,8)9;4*1-6-2-4-7(5-3-6)11(8,9)10/h13-36,57,60H,1-12H3;4*2-5H,1H3,(H,8,9,10)/q+4;;;;/p-4;
InChI Key
XFCJLTPKCPNBQV-UHFFFAOYSA-J;
Storage
2-8°C
Complexity
1460
Covalently-Bonded Unit Count
5
Exact Mass
1530.556g/mol
H-Bond Acceptor
14
H-Bond Donor
2
Heavy Atom Count
108
Monoisotopic Mass
1530.556g/mol
Rotatable Bond Count
8
Topological Polar Surface Area
320A^2
