TL;DR: 2- ethylacrylate (CAS 52956-81-7) is a chemical compound with molecular formula C16H7F23O2 and molecular weight 668.0079 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,12,12,12-icosafluoro-11-(trifluoromethyl)dodecyl] prop-2-enoate
Also Known As: 2- ethylacrylate, 2-(Perfluoro-9-methyldecyl)ethyl acrylate, (Perfluoro-9-methyldecyl)ethyl acrylate, 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,12,12,12-Icosafluoro-11-(trifluoromethyl)dodecyl acrylate, [3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,12,12,12-icosafluoro-11-(trifluoromethyl)dodecyl] prop-2-enoate
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H7F23O2 |
| Molecular Weight | 668.0079 g/mol |
| XLogP | 8.9 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 25 |
| Rotatable Bonds | 13 |
| Exact Mass | 668.0079 Da |
| Heavy Atoms | 41 |
| Complexity | 957.0 |
| SMILES | C=CC(=O)OCCC(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | SFACOKSPHOGYDO-UHFFFAOYSA-N |
The XLogP value of 8.9 indicates that 2- ethylacrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2- ethylacrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2- ethylacrylate has 0 hydrogen bond donor(s) and 25 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2- ethylacrylate is 52956-81-7.
The molecular formula of 2- ethylacrylate is C16H7F23O2.
The molecular weight of 2- ethylacrylate is 668.0079 g/mol.
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