TL;DR: Ammonium, diethylmethylphenyl-, bromide (CAS 63977-64-0) is a chemical compound with molecular formula C11H18BrN and molecular weight 243.06226 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl-methyl-phenylazanium bromide
Also Known As: Diethylmethylphenylammonium bromide, diethyl-methyl-phenylazanium bromide, Phenyl diethylmethyl ammonium bromide, Ro 2-3218, diethyl-methyl-phenylazanium,bromide
| Molecular Formula | C11H18BrN |
| Molecular Weight | 243.06226 g/mol |
| XLogP | -0.33 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.06226 Da |
| Heavy Atoms | 13 |
| Complexity | 121.0 |
| SMILES | CC[N+](C)(CC)C1=CC=CC=C1.[Br-] |
| InChIKey | VUHOLWZZFYWBLJ-UHFFFAOYSA-M |
The XLogP value of -0.33 indicates that Ammonium, diethylmethylphenyl-, bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 0.0 Ų, Ammonium, diethylmethylphenyl-, bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, diethylmethylphenyl-, bromide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ammonium, diethylmethylphenyl-, bromide is 63977-64-0.
The molecular formula of Ammonium, diethylmethylphenyl-, bromide is C11H18BrN.
The molecular weight of Ammonium, diethylmethylphenyl-, bromide is 243.06226 g/mol.
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