1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl-
TL;DR: 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl- (CAS 68391-55-9) is a chemical compound with molecular formula C11H13ClN2O and molecular weight 224.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-chloro-2-methylbenzimidazol-1-yl)propan-2-ol
Also Known As: 1- -2-propanol, 2-Methyl-5-chloro-3-(beta-hydroxypropyl)benzimidazole, 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl-, 1H-Benzimidazole-1-ethanol, 6-chloro-.alpha.,2-dimethyl-, 2-methyl-5-chloro-3-(
| Molecular Formula | C11H13ClN2O |
|---|---|
| Molecular Weight | 224.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.07164 |
| Heavy Atoms | 15 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 68391-55-9 |
|---|---|
| SMILES | CC1=NC2=C(N1CC(C)O)C=C(C=C2)Cl |
| InChIKey | BRCANRFFTFNXPU-UHFFFAOYSA-N |
Product Overview
1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl- (CAS 68391-55-9), with molecular formula C11H13ClN2O and molecular weight 224.07 g/mol. IUPAC: 1-(6-chloro-2-methylbenzimidazol-1-yl)propan-2-ol.
Chemical Property Profile of 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl-
Property Insights of 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl-. With a topological polar surface area (TPSA) of 38.1 Ų, 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl- has 1 hydrogen bond donor(s) and 2 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 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl-?
The CAS number of 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl- is 68391-55-9.
What is the molecular formula of 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl-?
The molecular formula of 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl- is C11H13ClN2O.
What is the molecular weight of 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl-?
The molecular weight of 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl- is 224.07 g/mol.
Where can I buy 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl-?
You can request a quote for 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzimidazole-1-ethanol, 6-chloro-alpha,2-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.