1,2-dimethyl-5-nitro-1H-benzimidazole
TL;DR: 1,2-dimethyl-5-nitro-1H-benzimidazole (CAS 2818-72-6) is a chemical compound with molecular formula C9H9N3O2 and molecular weight 191.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethyl-5-nitrobenzimidazole
Also Known As: 1,2-dimethyl-5-nitro-1H-benzimidazole, 1,2-dimethyl-5-nitrobenzimidazole, 1,2-dimethyl-5-nitro-1H-benzo[d]imidazole, benzimidazole, 1,2-dimethyl-5-nitro-, 5-Nitro-1,2-dimethyl-1H-benzimidazole
| Molecular Formula | C9H9N3O2 |
|---|---|
| Molecular Weight | 191.07 g/mol |
| LogP | 1.78992 |
| Topological Polar Surface Area | 60.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.06947 |
| Heavy Atoms | 14 |
| Complexity | 515.9966 |
Chemical Identifiers
| CAS Number | 2818-72-6 |
|---|---|
| SMILES | CC1=NC2=C(N1C)C=CC(=C2)[N+](=O)[O-] |
Product Overview
1,2-dimethyl-5-nitro-1H-benzimidazole (CAS 2818-72-6), with molecular formula C9H9N3O2 and molecular weight 191.07 g/mol. IUPAC: 1,2-dimethyl-5-nitrobenzimidazole.
Chemical Property Profile of 1,2-dimethyl-5-nitro-1H-benzimidazole
Property Insights of 1,2-dimethyl-5-nitro-1H-benzimidazole
The XLogP value of 1.78992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-dimethyl-5-nitro-1H-benzimidazole. The TPSA of 60.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-dimethyl-5-nitro-1H-benzimidazole. Following Lipinski's Rule of Five, 1,2-dimethyl-5-nitro-1H-benzimidazole has 0 hydrogen bond donor(s) and 3 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-nitro-1H-benzimidazole?
The CAS number of 1,2-dimethyl-5-nitro-1H-benzimidazole is 2818-72-6.
What is the molecular formula of 1,2-dimethyl-5-nitro-1H-benzimidazole?
The molecular formula of 1,2-dimethyl-5-nitro-1H-benzimidazole is C9H9N3O2.
What is the molecular weight of 1,2-dimethyl-5-nitro-1H-benzimidazole?
The molecular weight of 1,2-dimethyl-5-nitro-1H-benzimidazole is 191.07 g/mol.
Where can I buy 1,2-dimethyl-5-nitro-1H-benzimidazole?
You can request a quote for 1,2-dimethyl-5-nitro-1H-benzimidazole 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-nitro-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1,2-dimethyl-5-nitro-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.