3-chloro-N-(3-chloro-4-fluorophenyl)propanamide
TL;DR: 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide (CAS 131605-66-8) is a chemical compound with molecular formula C9H8Cl2FNO and molecular weight 234.9967 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-chloro-N-(3-chloro-4-fluorophenyl)propanamide
Also Known As: 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide, 3-chloro-N- propanamide, Propanamide, 3-chloro-N-(3-chloro-4-fluorophenyl)-, 3708AD, 3'-Chloro-4'-fluoro-3-chloropropionanilide
Technical Specifications
| Molecular Formula | C9H8Cl2FNO |
| Molecular Weight | 234.9967 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.9967 Da |
| Heavy Atoms | 14 |
| Complexity | 203.0 |
| SMILES | C1=CC(=C(C=C1NC(=O)CCCl)Cl)F |
| InChIKey | VJQJGNHCAHOAMD-UHFFFAOYSA-N |
Chemical Property Profile of 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide
Property Insights of 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide. With a topological polar surface area (TPSA) of 29.1 Ų, 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide 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
What is the CAS number of 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide?
The CAS number of 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide is 131605-66-8.
What is the molecular formula of 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide?
The molecular formula of 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide is C9H8Cl2FNO.
What is the molecular weight of 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide?
The molecular weight of 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide is 234.9967 g/mol.
Where can I buy 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide?
You can request a quote for 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide?
Yes, CoreyChem provides custom synthesis services for 3-chloro-N-(3-chloro-4-fluorophenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.