TL;DR: 2-[1-Chloro-2-(4-nitrophenyl)ethyl]pyridine (CAS 10027-07-3) is a chemical compound with molecular formula C13H11ClN2O2 and molecular weight 262.0509 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-chloro-2-(4-nitrophenyl)ethyl]pyridine
Also Known As: 2-[1-CHLORO-2-(4-NITROPHENYL)ETHYL]PYRIDINE, Pyridine,2-[1-chloro-2-(4-nitrophenyl)ethyl]-
| Molecular Formula | C13H11ClN2O2 |
| Molecular Weight | 262.0509 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 58.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.0509 Da |
| Heavy Atoms | 18 |
| Complexity | 275.0 |
| SMILES | C1=CC=NC(=C1)C(CC2=CC=C(C=C2)[N+](=O)[O-])Cl |
| InChIKey | DSFZZWIADVRZBV-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that 2-[1-Chloro-2-(4-nitrophenyl)ethyl]pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.7 Ų, 2-[1-Chloro-2-(4-nitrophenyl)ethyl]pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[1-Chloro-2-(4-nitrophenyl)ethyl]pyridine 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 2-[1-Chloro-2-(4-nitrophenyl)ethyl]pyridine is 10027-07-3.
The molecular formula of 2-[1-Chloro-2-(4-nitrophenyl)ethyl]pyridine is C13H11ClN2O2.
The molecular weight of 2-[1-Chloro-2-(4-nitrophenyl)ethyl]pyridine is 262.0509 g/mol.
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