alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol
TL;DR: alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol (CAS 206050-23-9) is a chemical compound with molecular formula C10H9F2N3O and molecular weight 225.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-difluorophenyl)-2-(1,2,4-triazol-1-yl)ethanol
Also Known As: Piperidine diol, Efinaconazole metabolite H3, Fluconazole Impurity 11, Fluconazole Impurity 40, Fluconazole Impurity 44
| Molecular Formula | C10H9F2N3O |
|---|---|
| Molecular Weight | 225.07 g/mol |
| LogP | 1.2899 |
| Topological Polar Surface Area | 50.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.07137 |
| Heavy Atoms | 16 |
| Complexity | 472.92133 |
Chemical Identifiers
| CAS Number | 206050-23-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)O |
Product Overview
alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol (CAS 206050-23-9), with molecular formula C10H9F2N3O and molecular weight 225.07 g/mol. IUPAC: 1-(2,4-difluorophenyl)-2-(1,2,4-triazol-1-yl)ethanol.
Chemical Property Profile of alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol
Property Insights of alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol
The XLogP value of 1.2899 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol. With a topological polar surface area (TPSA) of 50.94 Ų, alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol 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 alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol?
The CAS number of alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol is 206050-23-9.
What is the molecular formula of alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol?
The molecular formula of alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol is C10H9F2N3O.
What is the molecular weight of alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol?
The molecular weight of alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol is 225.07 g/mol.
Where can I buy alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol?
You can request a quote for alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol?
Yes, KEHONG BIO provides custom synthesis services for alpha-(2,4-Difluorophenyl)-1H-1,2,4-triazole-1-ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.