TL;DR: 2-chloro-N-(2-ethoxyethyl)aniline (CAS 127599-51-3) is a chemical compound with molecular formula C10H14ClNO and molecular weight 199.07639 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-(2-ethoxyethyl)aniline
Also Known As: 2-chloro-N-(2-ethoxyethyl)aniline, N-(2-Ethoxyethyl)-2-chloroaniline
| Molecular Formula | C10H14ClNO |
| Molecular Weight | 199.07639 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 199.07639 Da |
| Heavy Atoms | 13 |
| Complexity | 132.0 |
| SMILES | CCOCCNC1=CC=CC=C1Cl |
| InChIKey | TZUNMIOFAYTLJH-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(2-ethoxyethyl)aniline. With a topological polar surface area (TPSA) of 21.3 Ų, 2-chloro-N-(2-ethoxyethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(2-ethoxyethyl)aniline has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-chloro-N-(2-ethoxyethyl)aniline is 127599-51-3.
The molecular formula of 2-chloro-N-(2-ethoxyethyl)aniline is C10H14ClNO.
The molecular weight of 2-chloro-N-(2-ethoxyethyl)aniline is 199.07639 g/mol.
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