2-(1-Chloro-ethyl)-1H-benzoimidazole
TL;DR: 2-(1-Chloro-ethyl)-1H-benzoimidazole (CAS 333431-97-3) is a chemical compound with molecular formula C9H9ClN2 and molecular weight 180.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-chloroethyl)-1H-benzimidazole
Also Known As: 2-(1-Chloro-ethyl)-1H-benzoimidazole, 2-(1-chloroethyl)-1H-benzimidazole, 2-(chloroethyl)benzimidazole, 2-(1-chloroethyl)-1H-benzo[d]imidazole, 2-(1-chloroethyl)-1H-1,3-benzodiazole
| Molecular Formula | C9H9ClN2 |
|---|---|
| Molecular Weight | 180.05 g/mol |
| LogP | 2.8627 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.04543 |
| Heavy Atoms | 12 |
| Complexity | 359.0828 |
Chemical Identifiers
| CAS Number | 333431-97-3 |
|---|---|
| SMILES | CC(C1=NC2=CC=CC=C2N1)Cl |
Product Overview
2-(1-Chloro-ethyl)-1H-benzoimidazole (CAS 333431-97-3), with molecular formula C9H9ClN2 and molecular weight 180.05 g/mol. IUPAC: 2-(1-chloroethyl)-1H-benzimidazole.
Chemical Property Profile of 2-(1-Chloro-ethyl)-1H-benzoimidazole
Property Insights of 2-(1-Chloro-ethyl)-1H-benzoimidazole
The XLogP value of 2.8627 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Chloro-ethyl)-1H-benzoimidazole. With a topological polar surface area (TPSA) of 28.68 Ų, 2-(1-Chloro-ethyl)-1H-benzoimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Chloro-ethyl)-1H-benzoimidazole 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-(1-Chloro-ethyl)-1H-benzoimidazole?
The CAS number of 2-(1-Chloro-ethyl)-1H-benzoimidazole is 333431-97-3.
What is the molecular formula of 2-(1-Chloro-ethyl)-1H-benzoimidazole?
The molecular formula of 2-(1-Chloro-ethyl)-1H-benzoimidazole is C9H9ClN2.
What is the molecular weight of 2-(1-Chloro-ethyl)-1H-benzoimidazole?
The molecular weight of 2-(1-Chloro-ethyl)-1H-benzoimidazole is 180.05 g/mol.
Where can I buy 2-(1-Chloro-ethyl)-1H-benzoimidazole?
You can request a quote for 2-(1-Chloro-ethyl)-1H-benzoimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Chloro-ethyl)-1H-benzoimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Chloro-ethyl)-1H-benzoimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.