TL;DR: 4-[(2,6-Dichlorobenzyl)amino]phenol (CAS 158019-25-1) is a chemical compound with molecular formula C13H11Cl2NO and molecular weight 267.02176 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(2,6-dichlorophenyl)methylamino]phenol
Also Known As: 4-[(2,6-dichlorobenzyl)amino]phenol, 4-(2,6-Dichloro-benzylamino)-phenol, 4-[(2,6-dichlorophenyl)methylamino]phenol, AN-465/41672854
| Molecular Formula | C13H11Cl2NO |
| Molecular Weight | 267.02176 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.02176 Da |
| Heavy Atoms | 17 |
| Complexity | 221.0 |
| SMILES | C1=CC(=C(C(=C1)Cl)CNC2=CC=C(C=C2)O)Cl |
| InChIKey | NRXZKDUYFZZFRE-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that 4-[(2,6-Dichlorobenzyl)amino]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 4-[(2,6-Dichlorobenzyl)amino]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(2,6-Dichlorobenzyl)amino]phenol has 2 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 4-[(2,6-Dichlorobenzyl)amino]phenol is 158019-25-1.
The molecular formula of 4-[(2,6-Dichlorobenzyl)amino]phenol is C13H11Cl2NO.
The molecular weight of 4-[(2,6-Dichlorobenzyl)amino]phenol is 267.02176 g/mol.
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