TL;DR: Butylamine, N-methyl-4-(o-phenoxyphenoxy)-, hydrochloride (CAS 100482-76-6) is a chemical compound with molecular formula C17H22ClNO2 and molecular weight 307.1339 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-methyl-N-(2-phenoxyphenoxy)butan-1-amine;hydrochloride
Also Known As: N-Methyl-4-(o-phenoxyphenoxy)butylamine hydrochloride, Butylamine, N-methyl-4-(o-phenoxyphenoxy)-, hydrochloride, 1-(4-(Methylamino)butoxy)-2-phenoxybenzene hydrochloride, N-Methyl-N-(2-phenoxyphenoxy)-1-butanamine HCl, N-Methyl-N-(2-phenoxyphenoxy)-1-butanamine hydrochloride
| Molecular Formula | C17H22ClNO2 |
| Molecular Weight | 307.1339 g/mol |
| XLogP | 4.9264 |
| Topological Polar Surface Area (TPSA) | 21.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 307.1339 Da |
| Heavy Atoms | 21 |
| Complexity | 253.0 |
| SMILES | CCCCN(C)OC1=CC=CC=C1OC2=CC=CC=C2.Cl |
| InChIKey | DGENWOZYNWFADU-UHFFFAOYSA-N |
The XLogP value of 4.9264 indicates that Butylamine, N-methyl-4-(o-phenoxyphenoxy)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, Butylamine, N-methyl-4-(o-phenoxyphenoxy)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butylamine, N-methyl-4-(o-phenoxyphenoxy)-, hydrochloride has 1 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 Butylamine, N-methyl-4-(o-phenoxyphenoxy)-, hydrochloride is 100482-76-6.
The molecular formula of Butylamine, N-methyl-4-(o-phenoxyphenoxy)-, hydrochloride is C17H22ClNO2.
The molecular weight of Butylamine, N-methyl-4-(o-phenoxyphenoxy)-, hydrochloride is 307.1339 g/mol.
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