1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester
TL;DR: 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester (CAS 24116-17-4) is a chemical compound with molecular formula C7H10F3NO2 and molecular weight 197.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoroethyl 3-(aziridin-1-yl)propanoate
Also Known As: Aziridine propionic acid, 2,2,2-trifluoroethyl ester, 2,2,2-trifluoroethyl 3-(aziridin-1-yl)propanoate, 1-AZIRIDINEPROPIONIC ACID, 2,2,2-TRIFLUOROETHYL ESTER, 1-Aziridinepropanoic acid, 2,2,2-trifluoroethyl ester, 1-Aziridinepropionic acid 2,2,2-trifluoroethyl ester
| Molecular Formula | C7H10F3NO2 |
|---|---|
| Molecular Weight | 197.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 29.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 197.06636 |
| Heavy Atoms | 13 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 24116-17-4 |
|---|---|
| SMILES | C1CN1CCC(=O)OCC(F)(F)F |
| InChIKey | WEAQYEJHSMJQFB-UHFFFAOYSA-N |
Product Overview
1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester (CAS 24116-17-4), with molecular formula C7H10F3NO2 and molecular weight 197.07 g/mol. IUPAC: 2,2,2-trifluoroethyl 3-(aziridin-1-yl)propanoate.
Chemical Property Profile of 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester
Property Insights of 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester. With a topological polar surface area (TPSA) of 29.3 Ų, 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester has 0 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 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester?
The CAS number of 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester is 24116-17-4.
What is the molecular formula of 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester?
The molecular formula of 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester is C7H10F3NO2.
What is the molecular weight of 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester?
The molecular weight of 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester is 197.07 g/mol.
Where can I buy 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester?
You can request a quote for 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1-Aziridinepropionic acid, 2,2,2-trifluoroethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.