![Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate structure](/static/products/6906/69066-45-1.webp)
Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate
TL;DR: Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate (CAS 69066-45-1) is a chemical compound with molecular formula C10H8F3NO3 and molecular weight 247.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate
Also Known As: methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate, methyl {[4-(trifluoromethyl)phenyl]carbamoyl}formate, Methyl [4-(trifluoromethyl)phenyl]carbamoylformate, Methyl ([4-(trifluoromethyl)phenyl]carbamoyl)formate, methyl{[4-(trifluoromethyl)phenyl]carbamoyl}formate
| Molecular Formula | C10H8F3NO3 |
|---|---|
| Molecular Weight | 247.05 g/mol |
| LogP | 1.8169 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.04562 |
| Heavy Atoms | 17 |
| Complexity | 425.41742 |
Chemical Identifiers
| CAS Number | 69066-45-1 |
|---|---|
| SMILES | COC(=O)C(=O)NC1=CC=C(C=C1)C(F)(F)F |
Product Overview
Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate (CAS 69066-45-1), with molecular formula C10H8F3NO3 and molecular weight 247.05 g/mol. IUPAC: methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate.
Chemical Property Profile of Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate
Property Insights of Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate
The XLogP value of 1.8169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate has 1 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 Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate?
The CAS number of Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate is 69066-45-1.
What is the molecular formula of Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate?
The molecular formula of Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate is C10H8F3NO3.
What is the molecular weight of Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate?
The molecular weight of Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate is 247.05 g/mol.
Where can I buy Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate?
You can request a quote for Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-oxo-2-[4-(trifluoromethyl)anilino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.