6-Chloro-1H-benzimidazole-2-methanol
TL;DR: 6-Chloro-1H-benzimidazole-2-methanol (CAS 6953-65-7) is a chemical compound with molecular formula C8H7ClN2O and molecular weight 182.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-chloro-1H-benzimidazol-2-yl)methanol
Also Known As: (6-chloro-1H-benzo[d]imidazol-2-yl)methanol, (6-chloro-1H-benzimidazol-2-yl)methanol, (5-chloro-1H-benzimidazol-2-yl)methanol, (5-chloro-1H-benzo[d]iMidazol-2-yl)Methanol, 5-Chloro-2-hydroxymethylbenzimidazole
| Molecular Formula | C8H7ClN2O |
|---|---|
| Molecular Weight | 182.02 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 48.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.02469 |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
| Solubility | >27.4 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 6953-65-7 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)NC(=N2)CO |
| InChIKey | NIWRFQPRPJVQLO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Chloro-1H-benzimidazole-2-methanol (CAS 6953-65-7), with molecular formula C8H7ClN2O and molecular weight 182.02 g/mol. IUPAC: (6-chloro-1H-benzimidazol-2-yl)methanol.
Chemical Property Profile of 6-Chloro-1H-benzimidazole-2-methanol
Property Insights of 6-Chloro-1H-benzimidazole-2-methanol
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-1H-benzimidazole-2-methanol. With a topological polar surface area (TPSA) of 48.9 Ų, 6-Chloro-1H-benzimidazole-2-methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-1H-benzimidazole-2-methanol has 2 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 6-Chloro-1H-benzimidazole-2-methanol?
The CAS number of 6-Chloro-1H-benzimidazole-2-methanol is 6953-65-7.
What is the molecular formula of 6-Chloro-1H-benzimidazole-2-methanol?
The molecular formula of 6-Chloro-1H-benzimidazole-2-methanol is C8H7ClN2O.
What is the molecular weight of 6-Chloro-1H-benzimidazole-2-methanol?
The molecular weight of 6-Chloro-1H-benzimidazole-2-methanol is 182.02 g/mol.
Where can I buy 6-Chloro-1H-benzimidazole-2-methanol?
You can request a quote for 6-Chloro-1H-benzimidazole-2-methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-1H-benzimidazole-2-methanol?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-1H-benzimidazole-2-methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.