![3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid structure](/static/products/1263/126300-94-5.webp)
3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid
TL;DR: 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid (CAS 126300-94-5) is a chemical compound with molecular formula C12H13F2NO4 and molecular weight 273.08127 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-acetamido-3-[4-(difluoromethoxy)phenyl]propanoic acid
Also Known As: 3-[4-(difluoromethoxy)phenyl]-2-acetamidopropanoic acid, 2-acetamido-3-[4-(difluoromethoxy)phenyl]propanoic Acid
Technical Specifications
| Molecular Formula | C12H13F2NO4 |
| Molecular Weight | 273.08127 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 273.08127 Da |
| Heavy Atoms | 19 |
| Complexity | 317.0 |
| SMILES | CC(=O)NC(CC1=CC=C(C=C1)OC(F)F)C(=O)O |
| InChIKey | IQVKMJDBXHBGNR-UHFFFAOYSA-N |
Chemical Property Profile of 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid
Property Insights of 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid. Following Lipinski's Rule of Five, 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid has 2 hydrogen bond donor(s) and 6 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-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid?
The CAS number of 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid is 126300-94-5.
What is the molecular formula of 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid?
The molecular formula of 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid is C12H13F2NO4.
What is the molecular weight of 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid?
The molecular weight of 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid is 273.08127 g/mol.
Where can I buy 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid?
You can request a quote for 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid?
Yes, CoreyChem provides custom synthesis services for 3-[4-(Difluoromethoxy)phenyl]-2-acetamidopropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.