1,2-Dimethyl-5,6-dinitrobenzimidazole
TL;DR: 1,2-Dimethyl-5,6-dinitrobenzimidazole (CAS 90323-97-0) is a chemical compound with molecular formula C9H8N4O4 and molecular weight 236.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethyl-5,6-dinitrobenzimidazole
Also Known As: 1,2-dimethyl-5,6-dinitrobenzimidazole, 1H-Benzimidazole, 1,2-dimethyl-5,6-dinitro-, BAS 00157140, 5,6-dinitro-1,2-dimethyl-1H-benzimidazole, 1,2-dimethyl 5,6-dinitro benzimidazole
| Molecular Formula | C9H8N4O4 |
|---|---|
| Molecular Weight | 236.05 g/mol |
| LogP | 1.69812 |
| Topological Polar Surface Area | 104.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.05455 |
| Heavy Atoms | 17 |
| Complexity | 645.9735 |
Chemical Identifiers
| CAS Number | 90323-97-0 |
|---|---|
| SMILES | CC1=NC2=CC(=C(C=C2N1C)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
1,2-Dimethyl-5,6-dinitrobenzimidazole (CAS 90323-97-0), with molecular formula C9H8N4O4 and molecular weight 236.05 g/mol. IUPAC: 1,2-dimethyl-5,6-dinitrobenzimidazole.
Chemical Property Profile of 1,2-Dimethyl-5,6-dinitrobenzimidazole
Property Insights of 1,2-Dimethyl-5,6-dinitrobenzimidazole
The XLogP value of 1.69812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dimethyl-5,6-dinitrobenzimidazole. The TPSA of 104.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Dimethyl-5,6-dinitrobenzimidazole. Following Lipinski's Rule of Five, 1,2-Dimethyl-5,6-dinitrobenzimidazole has 0 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 1,2-Dimethyl-5,6-dinitrobenzimidazole?
The CAS number of 1,2-Dimethyl-5,6-dinitrobenzimidazole is 90323-97-0.
What is the molecular formula of 1,2-Dimethyl-5,6-dinitrobenzimidazole?
The molecular formula of 1,2-Dimethyl-5,6-dinitrobenzimidazole is C9H8N4O4.
What is the molecular weight of 1,2-Dimethyl-5,6-dinitrobenzimidazole?
The molecular weight of 1,2-Dimethyl-5,6-dinitrobenzimidazole is 236.05 g/mol.
Where can I buy 1,2-Dimethyl-5,6-dinitrobenzimidazole?
You can request a quote for 1,2-Dimethyl-5,6-dinitrobenzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dimethyl-5,6-dinitrobenzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dimethyl-5,6-dinitrobenzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.