4,5-Dibromo-1H-1,2,3-triazole
TL;DR: 4,5-Dibromo-1H-1,2,3-triazole (CAS 22300-52-3) is a chemical compound with molecular formula C2HBr2N3 and molecular weight 224.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dibromo-2H-triazole
Also Known As: 4,5-Dibromo-1H-1,2,3-triazole, 4,5-Dibromo-2H-1,2,3-triazole, dibromotriazole, 4,5-dibromo-2H-triazole, dibromo triazole
| Molecular Formula | C2HBr2N3 |
|---|---|
| Molecular Weight | 224.85 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 224.85371 |
| Heavy Atoms | 7 |
| Complexity | 60.0 |
Chemical Identifiers
| CAS Number | 22300-52-3 |
|---|---|
| SMILES | C1(=NNN=C1Br)Br |
| InChIKey | GUQUYKTWVBJKFL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,5-Dibromo-1H-1,2,3-triazole (CAS 22300-52-3), with molecular formula C2HBr2N3 and molecular weight 224.85 g/mol. IUPAC: 4,5-dibromo-2H-triazole.
Chemical Property Profile of 4,5-Dibromo-1H-1,2,3-triazole
Property Insights of 4,5-Dibromo-1H-1,2,3-triazole
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dibromo-1H-1,2,3-triazole. With a topological polar surface area (TPSA) of 41.6 Ų, 4,5-Dibromo-1H-1,2,3-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dibromo-1H-1,2,3-triazole has 1 hydrogen bond donor(s) and 2 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-Dibromo-1H-1,2,3-triazole?
The CAS number of 4,5-Dibromo-1H-1,2,3-triazole is 22300-52-3.
What is the molecular formula of 4,5-Dibromo-1H-1,2,3-triazole?
The molecular formula of 4,5-Dibromo-1H-1,2,3-triazole is C2HBr2N3.
What is the molecular weight of 4,5-Dibromo-1H-1,2,3-triazole?
The molecular weight of 4,5-Dibromo-1H-1,2,3-triazole is 224.85 g/mol.
Where can I buy 4,5-Dibromo-1H-1,2,3-triazole?
You can request a quote for 4,5-Dibromo-1H-1,2,3-triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dibromo-1H-1,2,3-triazole?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dibromo-1H-1,2,3-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.