| Catalog Number |
ACM14916871-4 |
| CAS |
14916-87-1 |
| Structure |
 |
| Description |
Copper(II) 1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-hexadecafluoro-29H,31H-phthalocyanine(F16CuPc) is an organic molecule that can be used as an electron transporting material with good air-stability and an electron mobility of 0.11 cm2 /Vs . It is majorly used in a variety of energy conservation based applications. |
| Synonyms |
1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-Hexadecafluorophthalocyanine copper(II) |
| IUPAC Name |
Copper;5,6,7,8,14,15,16,17,23,24,25,26,32,33,34,35-hexadecafluoro-2,11,20,29,37,39-hexaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13(18),14,16,19(39),20,22(27),23,25,28,30(37),31(36),32,34-nonadecaene |
| Molecular Weight |
863.9 |
| Molecular Formula |
C32CuF16N8 |
| Canonical SMILES |
C12=C(C(=C(C(=C1F)F)F)F)C3=NC4=NC(=NC5=C6C(=C([N-]5)N=C7C8=C(C(=C(C(=C8F)F)F)F)C(=N7)N=C2[N-]3)C(=C(C(=C6F)F)F)F)C9=C4C(=C(C(=C9F)F)F)F.[Cu+2] |
| InChI |
InChI=1S/C32F16N8.Cu/c33-9-1-2(10(34)18(42)17(9)41)26-49-25(1)53-27-3-4(12(36)20(44)19(43)11(3)35)29(50-27)55-31-7-8(16(40)24(48)23(47)15(7)39)32(52-31)56-30-6-5(28(51-30)54-26)13(37)21(45)22(46)14(6)38;/q-2;+2 |
| InChI Key |
FJAOBQORBYMRNO-UHFFFAOYSA-N |
| Melting Point |
>300 °C |
| Purity |
98% |
| Application |
F16CuPc can be used as an electron transporting layer for semiconducting applications such as an electron accepting material for organic photovoltaic cells and as a catalyst in biomimetic sensors. It may also be used in the fabrication of organic thin film transistors(OTFTs) and quartz crystal microbalance(QCM) based sensors. |
| Storage |
room temp |
| Complexity |
1590 |
| Covalently-Bonded Unit Count |
2 |
| Exact Mass |
862.92864 |
| Formal Charge |
0 |
| Heavy Atom Count |
57 |
| Hydrogen Bond Acceptor Count |
20 |
| Hydrogen Bond Donor Count |
0 |
| MDL Number |
MFCD00274642 |
| Monoisotopic Mass |
862.92864 |
| Rotatable Bond Count |
0 |
| Topological Polar Surface Area |
76.2 Ų |
