1-(1H-Benzimidazol-2-yl)ethanone
TL;DR: 1-(1H-Benzimidazol-2-yl)ethanone (CAS 939-70-8) is a chemical compound with molecular formula C9H8N2O and molecular weight 160.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-benzimidazol-2-yl)ethanone
Also Known As: 2-Acetylbenzimidazole, 1-(1H-benzo[d]imidazol-2-yl)ethanone, 1-(1H-benzimidazol-2-yl)ethanone, 2-acetyl benzimidazole, benzimidazolylethanone
| Molecular Formula | C9H8N2O |
|---|---|
| Molecular Weight | 160.06 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.06366 |
| Heavy Atoms | 12 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 939-70-8 |
|---|---|
| SMILES | CC(=O)C1=NC2=CC=CC=C2N1 |
| InChIKey | UYFMRVDIXXOWLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(1H-Benzimidazol-2-yl)ethanone (CAS 939-70-8), with molecular formula C9H8N2O and molecular weight 160.06 g/mol. IUPAC: 1-(1H-benzimidazol-2-yl)ethanone.
Chemical Property Profile of 1-(1H-Benzimidazol-2-yl)ethanone
Property Insights of 1-(1H-Benzimidazol-2-yl)ethanone
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1H-Benzimidazol-2-yl)ethanone. With a topological polar surface area (TPSA) of 45.8 Ų, 1-(1H-Benzimidazol-2-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1H-Benzimidazol-2-yl)ethanone 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 1-(1H-Benzimidazol-2-yl)ethanone?
The CAS number of 1-(1H-Benzimidazol-2-yl)ethanone is 939-70-8.
What is the molecular formula of 1-(1H-Benzimidazol-2-yl)ethanone?
The molecular formula of 1-(1H-Benzimidazol-2-yl)ethanone is C9H8N2O.
What is the molecular weight of 1-(1H-Benzimidazol-2-yl)ethanone?
The molecular weight of 1-(1H-Benzimidazol-2-yl)ethanone is 160.06 g/mol.
Where can I buy 1-(1H-Benzimidazol-2-yl)ethanone?
You can request a quote for 1-(1H-Benzimidazol-2-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1H-Benzimidazol-2-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1H-Benzimidazol-2-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.