TL;DR: Tetrabutyl ammonium, salt with 4-nitropyrocateco (CAS 11072-43-8) is a chemical compound with molecular formula C22H40N2O4 and molecular weight 396.2988 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxy-4-nitrophenolate;tetrabutylazanium
Also Known As: TETRABUTYL AMMONIUM, SALT WITH 4-NITROPYROCATECO, 2-hydroxy-4-nitrophenolate; tetrabutylazanium, N,N,N-Tributylbutan-1-aminium 2-hydroxy-4-nitrophenolate
| Molecular Formula | C22H40N2O4 |
| Molecular Weight | 396.2988 g/mol |
| XLogP | 5.3776 |
| Topological Polar Surface Area (TPSA) | 89.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 396.2988 Da |
| Heavy Atoms | 28 |
| Complexity | 271.0 |
| SMILES | CCCC[N+](CCCC)(CCCC)CCCC.C1=CC(=C(C=C1[N+](=O)[O-])O)[O-] |
| InChIKey | QLSMLEADCXSIIJ-UHFFFAOYSA-M |
The XLogP value of 5.3776 indicates that Tetrabutyl ammonium, salt with 4-nitropyrocateco is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Tetrabutyl ammonium, salt with 4-nitropyrocateco. Following Lipinski's Rule of Five, Tetrabutyl ammonium, salt with 4-nitropyrocateco has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Tetrabutyl ammonium, salt with 4-nitropyrocateco is 11072-43-8.
The molecular formula of Tetrabutyl ammonium, salt with 4-nitropyrocateco is C22H40N2O4.
The molecular weight of Tetrabutyl ammonium, salt with 4-nitropyrocateco is 396.2988 g/mol.
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