1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole
TL;DR: 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole (CAS 71735-32-5) is a chemical compound with molecular formula C6H3F5N2O and molecular weight 214.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3,3,3-pentafluoro-1-imidazol-1-ylpropan-1-one
Also Known As: 1-(Pentafluoropropionyl)imidazole, N-(pentafluoropropionyl)imidazole, 1-Methyl-2-decalone, N-pentafluoropropionylimidazole, 1-(pentafluoropropanyl)imidazole
| Molecular Formula | C6H3F5N2O |
|---|---|
| Molecular Weight | 214.02 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 214.01656 |
| Heavy Atoms | 14 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 71735-32-5 |
|---|---|
| SMILES | C1=CN(C=N1)C(=O)C(C(F)(F)F)(F)F |
| InChIKey | VZUSRIIEPFQBNE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole (CAS 71735-32-5), with molecular formula C6H3F5N2O and molecular weight 214.02 g/mol. IUPAC: 2,2,3,3,3-pentafluoro-1-imidazol-1-ylpropan-1-one.
Chemical Property Profile of 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole
Property Insights of 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole. With a topological polar surface area (TPSA) of 34.9 Ų, 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole has 0 hydrogen bond donor(s) and 7 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-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole?
The CAS number of 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole is 71735-32-5.
What is the molecular formula of 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole?
The molecular formula of 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole is C6H3F5N2O.
What is the molecular weight of 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole?
The molecular weight of 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole is 214.02 g/mol.
Where can I buy 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole?
You can request a quote for 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,2,3,3,3-Pentafluoro-1-oxopropyl)-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.