2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol
TL;DR: 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol (CAS 4954-06-7) is a chemical compound with molecular formula C10H12N2O and molecular weight 176.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylbenzimidazol-1-yl)ethanol
Also Known As: 2-(2-methyl-1H-benzimidazol-1-yl)ethanol, Bromocholine bromide, 2-(2-METHYL-1H-BENZO[D]IMIDAZOL-1-YL)ETHANOL, 1h-benzimidazole-1-ethanol, 2-methyl-, 2-(2-methylbenzimidazol-1-yl)ethanol
| Molecular Formula | C10H12N2O |
|---|---|
| Molecular Weight | 176.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.09496 |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 4954-06-7 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2N1CCO |
| InChIKey | CURPBJGJXFWNMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol (CAS 4954-06-7), with molecular formula C10H12N2O and molecular weight 176.09 g/mol. IUPAC: 2-(2-methylbenzimidazol-1-yl)ethanol.
Chemical Property Profile of 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol
Property Insights of 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol. With a topological polar surface area (TPSA) of 38.1 Ų, 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol 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 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol?
The CAS number of 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol is 4954-06-7.
What is the molecular formula of 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol?
The molecular formula of 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol is C10H12N2O.
What is the molecular weight of 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol?
The molecular weight of 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol is 176.09 g/mol.
Where can I buy 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol?
You can request a quote for 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.