2-Chloro-5,6-dinitrobenzimidazole
TL;DR: 2-Chloro-5,6-dinitrobenzimidazole (CAS 1849-05-4) is a chemical compound with molecular formula C7H3ClN4O4 and molecular weight 241.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5,6-dinitro-1H-benzimidazole
Also Known As: 2-Chloro-5,6-dinitrobenzimidazole, 2-Chloro-5,6-dinitro-1H-benzimidazole, 5,6-dinitro-2-chlorobenzimidazole, Benzimidazole, 2-chloro-5,6-dinitro-, 2-Chloro-5,6-dinitro-1H-benzimidazole #
| Molecular Formula | C7H3ClN4O4 |
|---|---|
| Molecular Weight | 241.98 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 241.98428 |
| Heavy Atoms | 16 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 1849-05-4 |
|---|---|
| SMILES | C1=C2C(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])N=C(N2)Cl |
| InChIKey | LPHPDNLKJSQDQG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-5,6-dinitrobenzimidazole (CAS 1849-05-4), with molecular formula C7H3ClN4O4 and molecular weight 241.98 g/mol. IUPAC: 2-chloro-5,6-dinitro-1H-benzimidazole.
Chemical Property Profile of 2-Chloro-5,6-dinitrobenzimidazole
Property Insights of 2-Chloro-5,6-dinitrobenzimidazole
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-5,6-dinitrobenzimidazole. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-5,6-dinitrobenzimidazole. Following Lipinski's Rule of Five, 2-Chloro-5,6-dinitrobenzimidazole 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 2-Chloro-5,6-dinitrobenzimidazole?
The CAS number of 2-Chloro-5,6-dinitrobenzimidazole is 1849-05-4.
What is the molecular formula of 2-Chloro-5,6-dinitrobenzimidazole?
The molecular formula of 2-Chloro-5,6-dinitrobenzimidazole is C7H3ClN4O4.
What is the molecular weight of 2-Chloro-5,6-dinitrobenzimidazole?
The molecular weight of 2-Chloro-5,6-dinitrobenzimidazole is 241.98 g/mol.
Where can I buy 2-Chloro-5,6-dinitrobenzimidazole?
You can request a quote for 2-Chloro-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 2-Chloro-5,6-dinitrobenzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5,6-dinitrobenzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.