6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole
TL;DR: 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole (CAS 3671-65-6) is a chemical compound with molecular formula C9H7F3N2O and molecular weight 216.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-2-(trifluoromethyl)-1H-benzimidazole
Also Known As: 6-Methoxy-2-(trifluoromethyl)-1H-benzo[d]imidazole, 6-methoxy-2-(trifluoromethyl)benzimidazole, 6-methoxy-2-(trifluoromethyl)-1H-benzimidazole, 6-Methoxy-2- benzimidazole, 2-Trifluoromethyl-5-methoxybenzimidazole
| Molecular Formula | C9H7F3N2O |
|---|---|
| Molecular Weight | 216.05 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 37.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.05104 |
| Heavy Atoms | 15 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 3671-65-6 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)N=C(N2)C(F)(F)F |
| InChIKey | GPYQJBAVCKSQTJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole (CAS 3671-65-6), with molecular formula C9H7F3N2O and molecular weight 216.05 g/mol. IUPAC: 6-methoxy-2-(trifluoromethyl)-1H-benzimidazole.
Chemical Property Profile of 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole
Property Insights of 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole. With a topological polar surface area (TPSA) of 37.9 Ų, 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole has 1 hydrogen bond donor(s) and 5 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 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole?
The CAS number of 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole is 3671-65-6.
What is the molecular formula of 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole?
The molecular formula of 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole is C9H7F3N2O.
What is the molecular weight of 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole?
The molecular weight of 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole is 216.05 g/mol.
Where can I buy 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole?
You can request a quote for 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 6-Methoxy-2-(trifluoromethyl)-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.