Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate
TL;DR: Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate (CAS 305865-06-9) is a chemical compound with molecular formula C10H17F3N2O3 and molecular weight 270.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-acetamido-3,3,3-trifluoro-2-(propan-2-ylamino)propanoate
Also Known As: Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate, ethyl N-acetyl-3,3,3-trifluoro-2-(propan-2-ylamino)alaninate, ethyl 2-acetamido-3,3,3-trifluoro-2-(propan-2-ylamino)propanoate, Ethyl 2-acetamido-3,3,3-trifluoro-N-propan-2-ylalaninate, 2-Acetylamino-3,3,3-trifluoro-2-isopropylamino-propionic acid ethyl ester
| Molecular Formula | C10H17F3N2O3 |
|---|---|
| Molecular Weight | 270.12 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 270.11914 |
| Heavy Atoms | 18 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 305865-06-9 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(C)C)NC(=O)C |
| InChIKey | GTNNLYUVCAMUEI-UHFFFAOYSA-N |
Product Overview
Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate (CAS 305865-06-9), with molecular formula C10H17F3N2O3 and molecular weight 270.12 g/mol. IUPAC: ethyl 2-acetamido-3,3,3-trifluoro-2-(propan-2-ylamino)propanoate.
Chemical Property Profile of Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate
Property Insights of Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate. Following Lipinski's Rule of Five, Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate has 2 hydrogen bond donor(s) and 7 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 Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate?
The CAS number of Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate is 305865-06-9.
What is the molecular formula of Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate?
The molecular formula of Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate is C10H17F3N2O3.
What is the molecular weight of Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate?
The molecular weight of Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate is 270.12 g/mol.
Where can I buy Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate?
You can request a quote for Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-acetamido-3,3,3-trifluoro-2-(isopropylamino)propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.