TL;DR: Bis(triphenylphosphine)nickel (II) bromide (CAS 14126-37-5) is a chemical compound with molecular formula C36H30Br2NiP2 and molecular weight 739.9543 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
nickel(2+);bis(triphenylphosphane);dibromide
Also Known As: NiBr2(PPh3)2, (S)-(+)-2-Amino-1-butanol, Bis(triphenylphosphine)nickel (II) bromide, Dibromobis(triphenylphosphine)nickel(II), nickelous;triphenylphosphane;dibromide
| Molecular Formula | C36H30Br2NiP2 |
| Molecular Weight | 739.9543 g/mol |
| XLogP | 0.8951 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 739.9543 Da |
| Heavy Atoms | 41 |
| Complexity | 202.0 |
| SMILES | C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ni+2].[Br-].[Br-] |
| InChIKey | QEKXARSPUFVXIX-UHFFFAOYSA-L |
The XLogP value of 0.8951 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(triphenylphosphine)nickel (II) bromide. With a topological polar surface area (TPSA) of 0.0 Ų, Bis(triphenylphosphine)nickel (II) bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(triphenylphosphine)nickel (II) bromide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Bis(triphenylphosphine)nickel (II) bromide is 14126-37-5.
The molecular formula of Bis(triphenylphosphine)nickel (II) bromide is C36H30Br2NiP2.
The molecular weight of Bis(triphenylphosphine)nickel (II) bromide is 739.9543 g/mol.
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