TL;DR: [1-(3,4-Dimethoxyphenyl)-1-methylethyl]amine hydrochloride (CAS 153002-39-2) is a chemical compound with molecular formula C11H18ClNO2 and molecular weight 231.1026 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3,4-dimethoxyphenyl)propan-2-amine;hydrochloride
Also Known As: AKOS BC-1002, 2-(3,4-dimethoxyphenyl)propan-2-amine hydrochloride, [1-(3,4-Dimethoxyphenyl)-1-methylethyl]amine hydrochloride, N,N-Dimethylveratrylamine hydrochloride, 2-(3,4-dimethoxyphenyl)propan-2-amine;hydrochloride
| Molecular Formula | C11H18ClNO2 |
| Molecular Weight | 231.1026 g/mol |
| XLogP | 2.3194 |
| Topological Polar Surface Area (TPSA) | 44.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.1026 Da |
| Heavy Atoms | 15 |
| Complexity | 182.0 |
| SMILES | CC(C)(C1=CC(=C(C=C1)OC)OC)N.Cl |
| InChIKey | GLOVSZFRXZZMDN-UHFFFAOYSA-N |
The XLogP value of 2.3194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1-(3,4-Dimethoxyphenyl)-1-methylethyl]amine hydrochloride. With a topological polar surface area (TPSA) of 44.5 Ų, [1-(3,4-Dimethoxyphenyl)-1-methylethyl]amine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1-(3,4-Dimethoxyphenyl)-1-methylethyl]amine hydrochloride has 2 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 [1-(3,4-Dimethoxyphenyl)-1-methylethyl]amine hydrochloride is 153002-39-2.
The molecular formula of [1-(3,4-Dimethoxyphenyl)-1-methylethyl]amine hydrochloride is C11H18ClNO2.
The molecular weight of [1-(3,4-Dimethoxyphenyl)-1-methylethyl]amine hydrochloride is 231.1026 g/mol.
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