2-(3-Nitrophenyl)benzimidazole
TL;DR: 2-(3-Nitrophenyl)benzimidazole (CAS 155112-92-8) is a chemical compound with molecular formula C13H9N3O2 and molecular weight 239.06947 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-nitrophenyl)-1H-benzimidazole
Also Known As: 2-(3-nitrophenyl)-1h-benzimidazole, 2-(3-nitrophenyl)-1H-benzo[d]imidazole, 2-(3-nitrophenyl)benzimidazole, 2-(3-nitrophenyl)-1H-1,3-benzodiazole, 2-(3-NITROPHENYL)-1H-BENZOIMIDAZOLE
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H9N3O2 |
| Molecular Weight | 239.06947 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 74.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.06947 Da |
| Heavy Atoms | 18 |
| Complexity | 318.0 |
| SMILES | C1=CC=C2C(=C1)NC(=N2)C3=CC(=CC=C3)[N+](=O)[O-] |
| InChIKey | GPFINXAYWOKPKM-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Nitrophenyl)benzimidazole
Property Insights of 2-(3-Nitrophenyl)benzimidazole
The XLogP value of 3.1 indicates that 2-(3-Nitrophenyl)benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Nitrophenyl)benzimidazole. Following Lipinski's Rule of Five, 2-(3-Nitrophenyl)benzimidazole has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(3-Nitrophenyl)benzimidazole?
The CAS number of 2-(3-Nitrophenyl)benzimidazole is 155112-92-8.
What is the molecular formula of 2-(3-Nitrophenyl)benzimidazole?
The molecular formula of 2-(3-Nitrophenyl)benzimidazole is C13H9N3O2.
What is the molecular weight of 2-(3-Nitrophenyl)benzimidazole?
The molecular weight of 2-(3-Nitrophenyl)benzimidazole is 239.06947 g/mol.
Where can I buy 2-(3-Nitrophenyl)benzimidazole?
You can request a quote for 2-(3-Nitrophenyl)benzimidazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Nitrophenyl)benzimidazole?
Yes, CoreyChem provides custom synthesis services for 2-(3-Nitrophenyl)benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.