2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime
TL;DR: 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime (CAS 4760-36-5) is a chemical compound with molecular formula C12H15N3O and molecular weight 217.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-methylbenzimidazol-2-yl)methoxy]propan-2-imine
Also Known As: AcetoneO-[ methyl]oxime, 2-Propanone, ((1-methylbenzimidazol-2-yl)methyl)oxime, 1-Methyl-2-((isopropylideneaminooxy)methyl)benzimidazole, Benzimidazole, 1-methyl-2-((isopropylideneaminooxy)methyl)-, N-[(1-methylbenzimidazol-2-yl)methoxy]propan-2-imine
| Molecular Formula | C12H15N3O |
|---|---|
| Molecular Weight | 217.12 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.1215 |
| Heavy Atoms | 16 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 4760-36-5 |
|---|---|
| SMILES | CC(=NOCC1=NC2=CC=CC=C2N1C)C |
| InChIKey | QLDKVEGPGBKPKC-UHFFFAOYSA-N |
Product Overview
2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime (CAS 4760-36-5), with molecular formula C12H15N3O and molecular weight 217.12 g/mol. IUPAC: N-[(1-methylbenzimidazol-2-yl)methoxy]propan-2-imine.
Chemical Property Profile of 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime
Property Insights of 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime. With a topological polar surface area (TPSA) of 39.4 Ų, 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime has 0 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-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime?
The CAS number of 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime is 4760-36-5.
What is the molecular formula of 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime?
The molecular formula of 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime is C12H15N3O.
What is the molecular weight of 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime?
The molecular weight of 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime is 217.12 g/mol.
Where can I buy 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime?
You can request a quote for 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanone, O-((1-methyl-1H-benzimidazol-2-yl)methyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.