TL;DR: Ammonium, (p-nitrophenyl)trimethyl-, chloride (CAS 15177-70-5) is a chemical compound with molecular formula C9H13ClN2O2 and molecular weight 216.06656 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trimethyl-(4-nitrophenyl)azanium chloride
Also Known As: p-Nitrophenyltrimethylammonium chloride, trimethyl-(4-nitrophenyl)azanium chloride, AMMONIUM, (p-NITROPHENYL)TRIMETHYL-, CHLORIDE, N,N,N-trimethyl-4-nitroanilinium chloride, Benzenaminium, N,N,N-trimethyl-4-nitro-, chloride
| Molecular Formula | C9H13ClN2O2 |
| Molecular Weight | 216.06656 g/mol |
| XLogP | -1.2 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.06656 Da |
| Heavy Atoms | 14 |
| Complexity | 185.0 |
| SMILES | C[N+](C)(C)C1=CC=C(C=C1)[N+](=O)[O-].[Cl-] |
| InChIKey | FHFNHITZETXPDI-UHFFFAOYSA-M |
The XLogP value of -1.2 indicates that Ammonium, (p-nitrophenyl)trimethyl-, chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 45.8 Ų, Ammonium, (p-nitrophenyl)trimethyl-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (p-nitrophenyl)trimethyl-, chloride has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ammonium, (p-nitrophenyl)trimethyl-, chloride is 15177-70-5.
The molecular formula of Ammonium, (p-nitrophenyl)trimethyl-, chloride is C9H13ClN2O2.
The molecular weight of Ammonium, (p-nitrophenyl)trimethyl-, chloride is 216.06656 g/mol.
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