TL;DR: 2-Butoxy-4,6-dichloro-1,3,5-triazine (CAS 13838-32-9) is a chemical compound with molecular formula C7H9Cl2N3O and molecular weight 221.01227 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-butoxy-4,6-dichloro-1,3,5-triazine
Also Known As: 2-Butoxy-4,6-dichloro-1,3,5-triazine, n-Butoxydichloro-S-triazine, 2-n-Butoxy-4,6-dichloro-1,3,5-triazine, 1,3,5-Triazine, 2-butoxy-4,6-dichloro-, 4-butoxy-2,6-dichloro-1,3,5-triazine
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H9Cl2N3O |
| Molecular Weight | 221.01227 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.01227 Da |
| Heavy Atoms | 13 |
| Complexity | 140.0 |
| SMILES | CCCCOC1=NC(=NC(=N1)Cl)Cl |
| InChIKey | ZTNVNAIEXWYGML-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that 2-Butoxy-4,6-dichloro-1,3,5-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.9 Ų, 2-Butoxy-4,6-dichloro-1,3,5-triazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butoxy-4,6-dichloro-1,3,5-triazine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Butoxy-4,6-dichloro-1,3,5-triazine is 13838-32-9.
The molecular formula of 2-Butoxy-4,6-dichloro-1,3,5-triazine is C7H9Cl2N3O.
The molecular weight of 2-Butoxy-4,6-dichloro-1,3,5-triazine is 221.01227 g/mol.
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