4,5,6,7-Tetrachloro-1-hydroxybenzotriazole
TL;DR: 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole (CAS 18226-02-3) is a chemical compound with molecular formula C6HCl4N3O and molecular weight 270.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,6,7-tetrachloro-1-hydroxybenzotriazole
Also Known As: tetrachloro-1H-1,2,3-benzotriazol-1-ol, 4,5,6,7-tetrachloro-1-hydroxybenzotriazole, 4,5,6,7-tetrachlorobenzotriazol-1-ol, 4,5,6,7-tetrachloro-1H-benzotriazol-1-ol, 4,5,6,7-tetrachloro-1-hydroxy-benzotriazole
| Molecular Formula | C6HCl4N3O |
|---|---|
| Molecular Weight | 270.89 g/mol |
| LogP | 3.2822 |
| Topological Polar Surface Area | 50.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 270.88736 |
| Heavy Atoms | 14 |
| Complexity | 523.50635 |
Chemical Identifiers
| CAS Number | 18226-02-3 |
|---|---|
| SMILES | C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)N(N=N2)O |
Product Overview
4,5,6,7-Tetrachloro-1-hydroxybenzotriazole (CAS 18226-02-3), with molecular formula C6HCl4N3O and molecular weight 270.89 g/mol. IUPAC: 4,5,6,7-tetrachloro-1-hydroxybenzotriazole.
Chemical Property Profile of 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole
Property Insights of 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole
The XLogP value of 3.2822 indicates that 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.94 Ų, 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole?
The CAS number of 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole is 18226-02-3.
What is the molecular formula of 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole?
The molecular formula of 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole is C6HCl4N3O.
What is the molecular weight of 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole?
The molecular weight of 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole is 270.89 g/mol.
Where can I buy 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole?
You can request a quote for 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6,7-Tetrachloro-1-hydroxybenzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.