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Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate
TL;DR: Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate (CAS 25518-39-2) is a chemical compound with molecular formula C6H8F3NO3 and molecular weight 199.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate
Also Known As: Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate, Methyl N-(trifluoroacetyl)alaninate, 2-(Trifluoroacetylamino)propionic acid methyl ester, N-Trifluoroacetyl-L-alanine methyl ester, methyl 2-(2,2,2-trifluoroacetylamino)propanoate
| Molecular Formula | C6H8F3NO3 |
|---|---|
| Molecular Weight | 199.05 g/mol |
| LogP | 0.2264 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.04562 |
| Heavy Atoms | 13 |
| Complexity | 213.66025 |
Chemical Identifiers
| CAS Number | 25518-39-2 |
|---|---|
| SMILES | CC(C(=O)OC)NC(=O)C(F)(F)F |
Product Overview
Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate (CAS 25518-39-2), with molecular formula C6H8F3NO3 and molecular weight 199.05 g/mol. IUPAC: methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate.
Chemical Property Profile of Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate
Property Insights of Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate
The XLogP value of 0.2264 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate 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-[(2,2,2-trifluoroacetyl)amino]propanoate?
The CAS number of Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate is 25518-39-2.
What is the molecular formula of Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate?
The molecular formula of Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate is C6H8F3NO3.
What is the molecular weight of Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate?
The molecular weight of Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate is 199.05 g/mol.
Where can I buy Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate?
You can request a quote for Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(2,2,2-trifluoroacetyl)amino]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.