6-Chloro-2-(chloromethyl)-1-methylbenzimidazole
TL;DR: 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole (CAS 109047-39-4) is a chemical compound with molecular formula C9H8Cl2N2 and molecular weight 214.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-(chloromethyl)-1-methylbenzimidazole
Also Known As: 2-(chloromethyl)-1-methyl-1H-benzo[d]imidazole, 6-chloro-2-(chloromethyl)-1-methylbenzimidazole, 1H-Benzimidazole, 6-chloro-2-(chloromethyl)-1-methyl-, 6-chloro-2-(chloromethyl)-1-methyl-1h-benzimidazole
| Molecular Formula | C9H8Cl2N2 |
|---|---|
| Molecular Weight | 214.01 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 214.00645 |
| Heavy Atoms | 13 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 109047-39-4 |
|---|---|
| SMILES | CN1C2=C(C=CC(=C2)Cl)N=C1CCl |
| InChIKey | ZIUIRFCBAHQRSK-UHFFFAOYSA-N |
Product Overview
6-Chloro-2-(chloromethyl)-1-methylbenzimidazole (CAS 109047-39-4), with molecular formula C9H8Cl2N2 and molecular weight 214.01 g/mol. IUPAC: 6-chloro-2-(chloromethyl)-1-methylbenzimidazole.
Chemical Property Profile of 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole
Property Insights of 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole. With a topological polar surface area (TPSA) of 17.8 Ų, 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole has 0 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 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole?
The CAS number of 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole is 109047-39-4.
What is the molecular formula of 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole?
The molecular formula of 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole is C9H8Cl2N2.
What is the molecular weight of 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole?
The molecular weight of 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole is 214.01 g/mol.
Where can I buy 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole?
You can request a quote for 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-2-(chloromethyl)-1-methylbenzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.