Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)-
TL;DR: Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)- (CAS 3671-18-9) is a chemical compound with molecular formula C8H3ClF3N3O2 and molecular weight 264.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-4-nitro-2-(trifluoromethyl)-1H-benzimidazole
Also Known As: 6-chloro-4-nitro-2-(trifluoromethyl)-1H-benzimidazole, BENZIMIDAZOLE, 6-CHLORO-4-NITRO-2-(TRIFLUOROMETHYL)-, 6-Chloro-4-nitro-2-(trifluoromethyl)benzimidazole, 6-Chloro-4-nitro-2- -1H-benzimidazole, Benzimidazole, 4-nitro-6-chloro-2-(trifluoromethyl)-
| Molecular Formula | C8H3ClF3N3O2 |
|---|---|
| Molecular Weight | 264.99 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 74.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 264.9866 |
| Heavy Atoms | 17 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 3671-18-9 |
|---|---|
| SMILES | C1=C(C=C(C2=C1NC(=N2)C(F)(F)F)[N+](=O)[O-])Cl |
| InChIKey | STOJWTVNHAJLBI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)- (CAS 3671-18-9), with molecular formula C8H3ClF3N3O2 and molecular weight 264.99 g/mol. IUPAC: 6-chloro-4-nitro-2-(trifluoromethyl)-1H-benzimidazole.
Chemical Property Profile of Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)-
Property Insights of Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)-. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)-. Following Lipinski's Rule of Five, Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)- has 1 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, 6-chloro-4-nitro-2-(trifluoromethyl)-?
The CAS number of Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)- is 3671-18-9.
What is the molecular formula of Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)-?
The molecular formula of Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)- is C8H3ClF3N3O2.
What is the molecular weight of Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)-?
The molecular weight of Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)- is 264.99 g/mol.
Where can I buy Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)-?
You can request a quote for Benzimidazole, 6-chloro-4-nitro-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, 6-chloro-4-nitro-2-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.