PCTs
2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1(37),2,4(9),5,7,10,12,14,16,18,20,22(27),23,25,28(38),29,31(36),32,34-nonadecaene-6,15,24,33-tetrasulfonic acid
Also Known As: PCTs|Tetrasulfophthalocyanine|Phthalocyaninetetrasulfonate|Phthalocyanine tetrasulfonic acid
| Molecular Formula | C32H18N8O12S4 |
|---|---|
| Molecular Weight | 833.9927 g/mol |
| LogP | 3.856 |
| Topological Polar Surface Area | 326.4 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 4 |
| Exact Mass | 833.9927 |
| Monoisotopic Mass | 833.9927 |
| Heavy Atoms | 56 |
| Complexity | 3608.3435 |
Chemical Identifiers
| CAS Number | 33308-41-7 |
|---|---|
| SMILES | C1=CC2=C(C=C1S(=O)(=O)O)C3=NC4=NC(=NC5=NC(=NC6=C7C=CC(=CC7=C(N6)N=C2N3)S(=O)(=O)O)C8=C5C=CC(=C8)S(=O)(=O)O)C9=C4C=CC(=C9)S(=O)(=O)O |
Product Overview
PCTs (CAS 33308-41-7), with molecular formula C32H18N8O12S4 and molecular weight 833.9927 g/mol. IUPAC: 2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1(37),2,4(9),5,7,10,12,14,16,18,20,22(27),23,25,28(38),29,31(36),32,34-nonadecaene-6,15,24,33-tetrasulfonic acid.
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