TL;DR: Ammonium, decamethylenebis(diethyl-(9-fluorenyl)-, dibromide, hemihydrate (CAS 63957-46-0) is a chemical compound with molecular formula C44H58Br2N2 and molecular weight 772.2967 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
10-[diethyl(9H-fluoren-9-yl)azaniumyl]decyl-diethyl-(9H-fluoren-9-yl)azanium dibromide
Also Known As: C44H58N2.2Br.1/2H2O, 1,10-Bis(9-fluorenyldiethyl-ammonium)decane bromide, C44-H58-N2.2Br.1/2H2-O, Decamethylenebis(diethyl-(9-fluorenyl)ammonium) dibromide hemihydrate, Ammonium, decamethylenebis(diethyl-(9-fluorenyl)-, dibromide
| Molecular Formula | C44H58Br2N2 |
| Molecular Weight | 772.2967 g/mol |
| XLogP | 5.37 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 17 |
| Exact Mass | 774.2946 Da |
| Heavy Atoms | 48 |
| Complexity | 772.0 |
| SMILES | CC[N+](CC)(CCCCCCCCCC[N+](CC)(CC)C1C2=CC=CC=C2C3=CC=CC=C13)C4C5=CC=CC=C5C6=CC=CC=C46.[Br-].[Br-] |
| InChIKey | BNXDKTBMUIPKNM-UHFFFAOYSA-L |
The XLogP value of 5.37 indicates that Ammonium, decamethylenebis(diethyl-(9-fluorenyl)-, dibromide, hemihydrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Ammonium, decamethylenebis(diethyl-(9-fluorenyl)-, dibromide, hemihydrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, decamethylenebis(diethyl-(9-fluorenyl)-, dibromide, hemihydrate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Ammonium, decamethylenebis(diethyl-(9-fluorenyl)-, dibromide, hemihydrate is 63957-46-0.
The molecular formula of Ammonium, decamethylenebis(diethyl-(9-fluorenyl)-, dibromide, hemihydrate is C44H58Br2N2.
The molecular weight of Ammonium, decamethylenebis(diethyl-(9-fluorenyl)-, dibromide, hemihydrate is 772.2967 g/mol.
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