5-(2-methylphenyl)-1H-1,2,3-triazole
TL;DR: 5-(2-methylphenyl)-1H-1,2,3-triazole (CAS 369363-70-2) is a chemical compound with molecular formula C9H9N3 and molecular weight 159.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-methylphenyl)-2H-triazole
Also Known As: Tolyltriazole, 5-Tolyltriazole, 4-(2-methylphenyl)-2H-triazole, 1,2,3-triazole analogue, 8, 5-(o-tolyl)-1h-1,2,3-triazole
| Molecular Formula | C9H9N3 |
|---|---|
| Molecular Weight | 159.08 g/mol |
| LogP | 1.78012 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 159.07965 |
| Heavy Atoms | 12 |
| Complexity | 365.0225 |
Chemical Identifiers
| CAS Number | 369363-70-2 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NNN=C2 |
Product Overview
5-(2-methylphenyl)-1H-1,2,3-triazole (CAS 369363-70-2), with molecular formula C9H9N3 and molecular weight 159.08 g/mol. IUPAC: 4-(2-methylphenyl)-2H-triazole.
Chemical Property Profile of 5-(2-methylphenyl)-1H-1,2,3-triazole
Property Insights of 5-(2-methylphenyl)-1H-1,2,3-triazole
The XLogP value of 1.78012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-methylphenyl)-1H-1,2,3-triazole. With a topological polar surface area (TPSA) of 41.57 Ų, 5-(2-methylphenyl)-1H-1,2,3-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-methylphenyl)-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 5-(2-methylphenyl)-1H-1,2,3-triazole?
The CAS number of 5-(2-methylphenyl)-1H-1,2,3-triazole is 369363-70-2.
What is the molecular formula of 5-(2-methylphenyl)-1H-1,2,3-triazole?
The molecular formula of 5-(2-methylphenyl)-1H-1,2,3-triazole is C9H9N3.
What is the molecular weight of 5-(2-methylphenyl)-1H-1,2,3-triazole?
The molecular weight of 5-(2-methylphenyl)-1H-1,2,3-triazole is 159.08 g/mol.
Where can I buy 5-(2-methylphenyl)-1H-1,2,3-triazole?
You can request a quote for 5-(2-methylphenyl)-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 5-(2-methylphenyl)-1H-1,2,3-triazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-methylphenyl)-1H-1,2,3-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.