![2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid structure](/static/products/4098/40986-93-4.webp)
2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid
TL;DR: 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid (CAS 40986-93-4) is a chemical compound with molecular formula C5H6F3NO3 and molecular weight 185.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,2,2-trifluoroacetyl)amino]propanoic acid
Also Known As: n-(trifluoroacetyl)alanine, 2-(trifluoroacetamido)propanoic acid, 2-[(2,2,2-trifluoroacetyl)amino]propanoic acid, 2-(Trifluoroacetylamino)propanoic acid, Alanine, N-(2,2,2-trifluoroacetyl)-
| Molecular Formula | C5H6F3NO3 |
|---|---|
| Molecular Weight | 185.03 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.02998 |
| Heavy Atoms | 12 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 40986-93-4 |
|---|---|
| SMILES | CC(C(=O)O)NC(=O)C(F)(F)F |
| InChIKey | WLVJROFMCNWTBX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid (CAS 40986-93-4), with molecular formula C5H6F3NO3 and molecular weight 185.03 g/mol. IUPAC: 2-[(2,2,2-trifluoroacetyl)amino]propanoic acid.
Chemical Property Profile of 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid
Property Insights of 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid. Following Lipinski's Rule of Five, 2-[(2,2,2-Trifluoroacetyl)amino]propanoic 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
Frequently Asked Questions
What is the CAS number of 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid?
The CAS number of 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid is 40986-93-4.
What is the molecular formula of 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid?
The molecular formula of 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid is C5H6F3NO3.
What is the molecular weight of 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid?
The molecular weight of 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid is 185.03 g/mol.
Where can I buy 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid?
You can request a quote for 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2,2,2-Trifluoroacetyl)amino]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.