UCL 1684 ditrifluoroacetate
17,24-diaza-1,9-diazoniaheptacyclo[23.6.2.29,16.219,22.13,7.010,15.026,31]octatriaconta-1(32),3(38),4,6,9(37),10,12,14,16(36),19,21,25(33),26,28,30,34-hexadecaene;bis(2,2,2-trifluoroacetate)
Also Known As: Tocris-1310|UCL 1684 ditrifluoroacetate|UCL 1684|NCGC00025372-01|UCL 1684 Ditrifluoroacetate hydrate|SR-01000597955-1|17,24-Diaza-1,9-diazoniaheptacyclo[23.6.2.29,16.219,22.13,7.010,15.026,31]octatriaconta-1(32),3(38),4,6,9(37),10,12,14,16(36),19,21,25(33),26,28,30,34-hexadecaene;2,2,2-trifluoroacetate
| Molecular Formula | C38H30F6N4O4 |
|---|---|
| Molecular Weight | 720.2171 g/mol |
| LogP | 4.7994 |
| Topological Polar Surface Area | 112.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 720.2171 |
| Monoisotopic Mass | 720.2171 |
| Heavy Atoms | 52 |
| Complexity | 2054.5745 |
Chemical Identifiers
| CAS Number | 201147-19-5 |
|---|---|
| SMILES | C1C2=CC=C(CNC3=CC=[N+](CC4=CC=CC(=C4)C[N+]5=CC=C(N1)C6=CC=CC=C65)C7=CC=CC=C37)C=C2.C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-] |
Product Overview
UCL 1684 ditrifluoroacetate (CAS 201147-19-5), with molecular formula C38H30F6N4O4 and molecular weight 720.2171 g/mol. IUPAC: 17,24-diaza-1,9-diazoniaheptacyclo[23.6.2.29,16.219,22.13,7.010,15.026,31]octatriaconta-1(32),3(38),4,6,9(37),10,12,14,16(36),19,21,25(33),26,28,30,34-hexadecaene;bis(2,2,2-trifluoroacetate).
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