2-Chlorobenzimidazole
TL;DR: 2-Chlorobenzimidazole (CAS 4857-06-1) is a chemical compound with molecular formula C7H5ClN2 and molecular weight 152.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1H-benzimidazole
Also Known As: 2-Chlorobenzimidazole, 2-Chloro-1H-benzimidazole, 2-chloro-1H-benzo[d]imidazole, 1H-Benzimidazole, 2-chloro-, null
| Molecular Formula | C7H5ClN2 |
|---|---|
| Molecular Weight | 152.01 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 152.01413 |
| Heavy Atoms | 10 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 4857-06-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)Cl |
| InChIKey | AYPSHJCKSDNETA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chlorobenzimidazole (CAS 4857-06-1), with molecular formula C7H5ClN2 and molecular weight 152.01 g/mol. IUPAC: 2-chloro-1H-benzimidazole.
Chemical Property Profile of 2-Chlorobenzimidazole
Property Insights of 2-Chlorobenzimidazole
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chlorobenzimidazole. With a topological polar surface area (TPSA) of 28.7 Ų, 2-Chlorobenzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorobenzimidazole has 1 hydrogen bond donor(s) and 1 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-Chlorobenzimidazole?
The CAS number of 2-Chlorobenzimidazole is 4857-06-1.
What is the molecular formula of 2-Chlorobenzimidazole?
The molecular formula of 2-Chlorobenzimidazole is C7H5ClN2.
What is the molecular weight of 2-Chlorobenzimidazole?
The molecular weight of 2-Chlorobenzimidazole is 152.01 g/mol.
Where can I buy 2-Chlorobenzimidazole?
You can request a quote for 2-Chlorobenzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chlorobenzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Chlorobenzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.