2-Acetyl-1-methylbenzimidazole oxime
TL;DR: 2-Acetyl-1-methylbenzimidazole oxime (CAS 945-78-8) is a chemical compound with molecular formula C10H11N3O and molecular weight 189.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(1-methylbenzimidazol-2-yl)ethylidene]hydroxylamine
Also Known As: 2-acetyl-1-methylbenzimidazole oxime, Ethanone, 1-(1-methyl-1H-benzimidazol-2-yl)-, oxime (9CI)
| Molecular Formula | C10H11N3O |
|---|---|
| Molecular Weight | 189.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.09021 |
| Heavy Atoms | 14 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 945-78-8 |
|---|---|
| SMILES | CC(=NO)C1=NC2=CC=CC=C2N1C |
| InChIKey | RVQBDRBJSRUURF-UHFFFAOYSA-N |
Product Overview
2-Acetyl-1-methylbenzimidazole oxime (CAS 945-78-8), with molecular formula C10H11N3O and molecular weight 189.09 g/mol. IUPAC: N-[1-(1-methylbenzimidazol-2-yl)ethylidene]hydroxylamine.
Chemical Property Profile of 2-Acetyl-1-methylbenzimidazole oxime
Property Insights of 2-Acetyl-1-methylbenzimidazole oxime
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Acetyl-1-methylbenzimidazole oxime. With a topological polar surface area (TPSA) of 50.4 Ų, 2-Acetyl-1-methylbenzimidazole oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Acetyl-1-methylbenzimidazole oxime has 1 hydrogen bond donor(s) and 3 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-Acetyl-1-methylbenzimidazole oxime?
The CAS number of 2-Acetyl-1-methylbenzimidazole oxime is 945-78-8.
What is the molecular formula of 2-Acetyl-1-methylbenzimidazole oxime?
The molecular formula of 2-Acetyl-1-methylbenzimidazole oxime is C10H11N3O.
What is the molecular weight of 2-Acetyl-1-methylbenzimidazole oxime?
The molecular weight of 2-Acetyl-1-methylbenzimidazole oxime is 189.09 g/mol.
Where can I buy 2-Acetyl-1-methylbenzimidazole oxime?
You can request a quote for 2-Acetyl-1-methylbenzimidazole oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetyl-1-methylbenzimidazole oxime?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetyl-1-methylbenzimidazole oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.