3-(1H-1,2,3-triazol-5-yl)phenol
TL;DR: 3-(1H-1,2,3-triazol-5-yl)phenol (CAS 369363-54-2) is a chemical compound with molecular formula C8H7N3O and molecular weight 161.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2H-triazol-4-yl)phenol
Also Known As: 3-(2H-triazol-4-yl)phenol, 1,2,3-triazole analogue, 19, 3-(1H-1,2,3-triazol-5-yl)phenol, 3-(2H-1,2,3-triazol-4-yl)phenol, 3-(1H-1,2,3-triazol-4-yl)phenol
| Molecular Formula | C8H7N3O |
|---|---|
| Molecular Weight | 161.06 g/mol |
| LogP | 1.1773 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.05891 |
| Heavy Atoms | 12 |
| Complexity | 369.55182 |
Chemical Identifiers
| CAS Number | 369363-54-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)O)C2=NNN=C2 |
Product Overview
3-(1H-1,2,3-triazol-5-yl)phenol (CAS 369363-54-2), with molecular formula C8H7N3O and molecular weight 161.06 g/mol. IUPAC: 3-(2H-triazol-4-yl)phenol.
Chemical Property Profile of 3-(1H-1,2,3-triazol-5-yl)phenol
Property Insights of 3-(1H-1,2,3-triazol-5-yl)phenol
The XLogP value of 1.1773 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1H-1,2,3-triazol-5-yl)phenol. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1H-1,2,3-triazol-5-yl)phenol. Following Lipinski's Rule of Five, 3-(1H-1,2,3-triazol-5-yl)phenol has 2 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 3-(1H-1,2,3-triazol-5-yl)phenol?
The CAS number of 3-(1H-1,2,3-triazol-5-yl)phenol is 369363-54-2.
What is the molecular formula of 3-(1H-1,2,3-triazol-5-yl)phenol?
The molecular formula of 3-(1H-1,2,3-triazol-5-yl)phenol is C8H7N3O.
What is the molecular weight of 3-(1H-1,2,3-triazol-5-yl)phenol?
The molecular weight of 3-(1H-1,2,3-triazol-5-yl)phenol is 161.06 g/mol.
Where can I buy 3-(1H-1,2,3-triazol-5-yl)phenol?
You can request a quote for 3-(1H-1,2,3-triazol-5-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-1,2,3-triazol-5-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-1,2,3-triazol-5-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.