Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)-
TL;DR: Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)- (CAS 113551-23-8) is a chemical compound with molecular formula C13H9N3O3 and molecular weight 255.06439 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(6-nitro-1H-benzimidazol-2-yl)phenol
Also Known As: Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)-, BAS 00255311, 4-(5-Nitro-1H-benzoimidazol-2-yl)phenol, 4-(6-Nitro-1H-benzimidazol-2-yl)phenol, 4-(5-Nitro-1H-benzoimidazol-2-yl)-phenol
Technical Specifications
| Molecular Formula | C13H9N3O3 |
| Molecular Weight | 255.06439 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 94.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 255.06439 Da |
| Heavy Atoms | 19 |
| Complexity | 339.0 |
| SMILES | C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])O |
| InChIKey | QPAUGSYVFGVSOV-UHFFFAOYSA-N |
Chemical Property Profile of Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)-
Property Insights of Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)-
The XLogP value of 3.1 indicates that Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)-. Following Lipinski's Rule of Five, Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)-?
The CAS number of Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)- is 113551-23-8.
What is the molecular formula of Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)-?
The molecular formula of Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)- is C13H9N3O3.
What is the molecular weight of Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)-?
The molecular weight of Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)- is 255.06439 g/mol.
Where can I buy Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)-?
You can request a quote for Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)-?
Yes, CoreyChem provides custom synthesis services for Phenol, 4-(5-nitro-1H-benzimidazol-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.