1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate
TL;DR: 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate (CAS 13057-08-4) is a chemical compound with molecular formula C6H3F7O2 and molecular weight 240.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,2,3,3,3-heptafluoropropan-2-yl prop-2-enoate
Also Known As: Heptafluoroisopropyl acrylate, HEPTAFLUOROISOPROPYLACRYLATE, perfluoroisopropyl acrylate, PFIP-A, heptafluoro-2-propyl acrylate
| Molecular Formula | C6H3F7O2 |
|---|---|
| Molecular Weight | 240.00 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.00212 |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 13057-08-4 |
|---|---|
| SMILES | C=CC(=O)OC(C(F)(F)F)(C(F)(F)F)F |
| InChIKey | JTCVKNUSIGHJRG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate (CAS 13057-08-4), with molecular formula C6H3F7O2 and molecular weight 240.00 g/mol. IUPAC: 1,1,1,2,3,3,3-heptafluoropropan-2-yl prop-2-enoate.
Chemical Property Profile of 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate
Property Insights of 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate
The XLogP value of 3.3 indicates that 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate has 0 hydrogen bond donor(s) and 9 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 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate?
The CAS number of 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate is 13057-08-4.
What is the molecular formula of 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate?
The molecular formula of 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate is C6H3F7O2.
What is the molecular weight of 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate?
The molecular weight of 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate is 240.00 g/mol.
Where can I buy 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate?
You can request a quote for 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate?
Yes, KEHONG BIO provides custom synthesis services for 1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.