Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-
TL;DR: Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)- (CAS 122587-20-6) is a chemical compound with molecular formula C6H3Cl2NO4 and molecular weight 222.94391 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,4-dichloro-5-nitrofuran-2-yl)ethanone
Also Known As: 3,4-Dichloro-5-nitro-2-acetylfuran, Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-, 1-(3,4-dichloro-5-nitrofuran-2-yl)ethanone, 1-(3,4-Dichloro-5-nitro-2-furanyl)ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-ethanone
Technical Specifications
| Molecular Formula | C6H3Cl2NO4 |
| Molecular Weight | 222.94391 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 76.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.94391 Da |
| Heavy Atoms | 13 |
| Complexity | 241.0 |
| SMILES | CC(=O)C1=C(C(=C(O1)[N+](=O)[O-])Cl)Cl |
| InChIKey | XFXWVERCUJGBEA-UHFFFAOYSA-N |
Chemical Property Profile of Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-
Property Insights of Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-. Following Lipinski's Rule of Five, Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-?
The CAS number of Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)- is 122587-20-6.
What is the molecular formula of Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-?
The molecular formula of Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)- is C6H3Cl2NO4.
What is the molecular weight of Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-?
The molecular weight of Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)- is 222.94391 g/mol.
Where can I buy Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-?
You can request a quote for Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)-?
Yes, CoreyChem provides custom synthesis services for Ethanone, 1-(3,4-dichloro-5-nitro-2-furanyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.