TL;DR: Nickel phthalocyanine (CAS 14055-02-8) is a chemical compound with molecular formula C32H16N8Ni and molecular weight 570.08514 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene;nickel(2+)
Also Known As: Nickel phthalocyanine, Nickel(II) phthalocyanine, NiPc, nickelous [?], Nickel phthalocyanine blue
| Molecular Formula | C32H16N8Ni |
| Molecular Weight | 570.08514 g/mol |
| XLogP | 6.12 |
| Topological Polar Surface Area (TPSA) | 79.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 570.08514 Da |
| Heavy Atoms | 41 |
| Complexity | 709.0 |
| SMILES | C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=N7)N=C2[N-]3)C9=CC=CC=C94.[Ni+2] |
| InChIKey | LVIYYTJTOKJJOC-UHFFFAOYSA-N |
The XLogP value of 6.12 indicates that Nickel phthalocyanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Nickel phthalocyanine. Following Lipinski's Rule of Five, Nickel phthalocyanine has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Nickel phthalocyanine is 14055-02-8.
The molecular formula of Nickel phthalocyanine is C32H16N8Ni.
The molecular weight of Nickel phthalocyanine is 570.08514 g/mol.
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