4,5-dibromo-1-methyl-1H-1,2,3-triazole
TL;DR: 4,5-dibromo-1-methyl-1H-1,2,3-triazole (CAS 25537-64-8) is a chemical compound with molecular formula C3H3Br2N3 and molecular weight 238.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dibromo-1-methyltriazole
Also Known As: 4,5-Dibromo-1-methyl-1H-1,2,3-triazole, 4,5-Dibromo-1-methyl-1,2,3-triazole, 4,5-dibromo-1-methyltriazole, 4,5-dibromo-1-methyl-triazole, 4,5-dibromo-1-methyl-1H-[1,2,3]triazole
| Molecular Formula | C3H3Br2N3 |
|---|---|
| Molecular Weight | 238.87 g/mol |
| LogP | 1.3401 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 238.86937 |
| Heavy Atoms | 8 |
| Complexity | 174.90865 |
Chemical Identifiers
| CAS Number | 25537-64-8 |
|---|---|
| SMILES | CN1C(=C(N=N1)Br)Br |
Product Overview
4,5-dibromo-1-methyl-1H-1,2,3-triazole (CAS 25537-64-8), with molecular formula C3H3Br2N3 and molecular weight 238.87 g/mol. IUPAC: 4,5-dibromo-1-methyltriazole.
Chemical Property Profile of 4,5-dibromo-1-methyl-1H-1,2,3-triazole
Property Insights of 4,5-dibromo-1-methyl-1H-1,2,3-triazole
The XLogP value of 1.3401 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-dibromo-1-methyl-1H-1,2,3-triazole. With a topological polar surface area (TPSA) of 30.71 Ų, 4,5-dibromo-1-methyl-1H-1,2,3-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-dibromo-1-methyl-1H-1,2,3-triazole has 0 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-1-methyl-1H-1,2,3-triazole?
The CAS number of 4,5-dibromo-1-methyl-1H-1,2,3-triazole is 25537-64-8.
What is the molecular formula of 4,5-dibromo-1-methyl-1H-1,2,3-triazole?
The molecular formula of 4,5-dibromo-1-methyl-1H-1,2,3-triazole is C3H3Br2N3.
What is the molecular weight of 4,5-dibromo-1-methyl-1H-1,2,3-triazole?
The molecular weight of 4,5-dibromo-1-methyl-1H-1,2,3-triazole is 238.87 g/mol.
Where can I buy 4,5-dibromo-1-methyl-1H-1,2,3-triazole?
You can request a quote for 4,5-dibromo-1-methyl-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-1-methyl-1H-1,2,3-triazole?
Yes, KEHONG BIO provides custom synthesis services for 4,5-dibromo-1-methyl-1H-1,2,3-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.