Benzimidazole-4,7-diol, 2-(trifluoromethyl)-
TL;DR: Benzimidazole-4,7-diol, 2-(trifluoromethyl)- (CAS 89427-12-3) is a chemical compound with molecular formula C8H5F3N2O2 and molecular weight 218.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(trifluoromethyl)-1H-benzimidazole-4,7-diol
Also Known As: 2-(Trifluoromethyl)benzimidazole-4,7-diol, BENZIMIDAZOLE-4,7-DIOL, 2-(TRIFLUOROMETHYL)-, 2-(trifluoromethyl)-1H-benzimidazole-4,7-diol, 2-(Trifluoromethyl)-1H-1,3-benzimidazole-4,7-diol, RefChem:325993
| Molecular Formula | C8H5F3N2O2 |
|---|---|
| Molecular Weight | 218.03 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 69.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.03032 |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 89427-12-3 |
|---|---|
| SMILES | C1=CC(=C2C(=C1O)NC(=N2)C(F)(F)F)O |
| InChIKey | DCFYIZVYJUHHPR-UHFFFAOYSA-N |
Product Overview
Benzimidazole-4,7-diol, 2-(trifluoromethyl)- (CAS 89427-12-3), with molecular formula C8H5F3N2O2 and molecular weight 218.03 g/mol. IUPAC: 2-(trifluoromethyl)-1H-benzimidazole-4,7-diol.
Chemical Property Profile of Benzimidazole-4,7-diol, 2-(trifluoromethyl)-
Property Insights of Benzimidazole-4,7-diol, 2-(trifluoromethyl)-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzimidazole-4,7-diol, 2-(trifluoromethyl)-. The TPSA of 69.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzimidazole-4,7-diol, 2-(trifluoromethyl)-. Following Lipinski's Rule of Five, Benzimidazole-4,7-diol, 2-(trifluoromethyl)- has 3 hydrogen bond donor(s) and 6 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 Benzimidazole-4,7-diol, 2-(trifluoromethyl)-?
The CAS number of Benzimidazole-4,7-diol, 2-(trifluoromethyl)- is 89427-12-3.
What is the molecular formula of Benzimidazole-4,7-diol, 2-(trifluoromethyl)-?
The molecular formula of Benzimidazole-4,7-diol, 2-(trifluoromethyl)- is C8H5F3N2O2.
What is the molecular weight of Benzimidazole-4,7-diol, 2-(trifluoromethyl)-?
The molecular weight of Benzimidazole-4,7-diol, 2-(trifluoromethyl)- is 218.03 g/mol.
Where can I buy Benzimidazole-4,7-diol, 2-(trifluoromethyl)-?
You can request a quote for Benzimidazole-4,7-diol, 2-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzimidazole-4,7-diol, 2-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzimidazole-4,7-diol, 2-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.