Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)-
TL;DR: Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)- (CAS 6609-38-7) is a chemical compound with molecular formula C8H3F3N4O4 and molecular weight 276.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dinitro-2-(trifluoromethyl)-1H-benzimidazole
Also Known As: BENZIMIDAZOLE, 4,6-DINITRO-2-(TRIFLUOROMETHYL)-, 4,6-Dinitro-2-(trifluoromethyl)benzimidazole, 4,6-dinitro-2-(trifluoromethyl)-1H-benzimidazole, 4,6-Dinitro-2-(trifluoromethyl)-1H-1,3-benzimidazole, 4,6-DINITRO-2-(TRIFLUOROMETHYL)-1H-1,3-BENZODIAZOLE
| Molecular Formula | C8H3F3N4O4 |
|---|---|
| Molecular Weight | 276.01 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 276.01065 |
| Heavy Atoms | 19 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 6609-38-7 |
|---|---|
| SMILES | C1=C(C=C(C2=C1NC(=N2)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | ABJSFSLMGRVNBG-UHFFFAOYSA-N |
Product Overview
Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)- (CAS 6609-38-7), with molecular formula C8H3F3N4O4 and molecular weight 276.01 g/mol. IUPAC: 4,6-dinitro-2-(trifluoromethyl)-1H-benzimidazole.
Chemical Property Profile of Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)-
Property Insights of Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)-. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)-. Following Lipinski's Rule of Five, Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)- has 1 hydrogen bond donor(s) and 8 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, 4,6-dinitro-2-(trifluoromethyl)-?
The CAS number of Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)- is 6609-38-7.
What is the molecular formula of Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)-?
The molecular formula of Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)- is C8H3F3N4O4.
What is the molecular weight of Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)-?
The molecular weight of Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)- is 276.01 g/mol.
Where can I buy Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)-?
You can request a quote for Benzimidazole, 4,6-dinitro-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, 4,6-dinitro-2-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.