TL;DR: 2-(Methyl((nonafluorobutyl)sulfonyl)amino)ethylacrylate (CAS 67584-55-8) is a chemical compound with molecular formula C10H10F9NO4S and molecular weight 411.01868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[methyl(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)amino]ethyl prop-2-enoate
Also Known As: EX-A6223, EC 266-733-5, 2-[methyl[ sulphonyl]amino]ethylacrylate, 2-(Methyl((nonafluorobutyl)sulfonyl)amino)ethylacrylate, 2-Propenoic acid, 2-[methyl[(nonafluorobutyl)sulfonyl]amino]ethyl ester
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H10F9NO4S |
| Molecular Weight | 411.01868 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 9 |
| Exact Mass | 411.01868 Da |
| Heavy Atoms | 25 |
| Complexity | 609.0 |
| SMILES | CN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | KEMCLRGAIUJRAN-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 2-(Methyl((nonafluorobutyl)sulfonyl)amino)ethylacrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Methyl((nonafluorobutyl)sulfonyl)amino)ethylacrylate. Following Lipinski's Rule of Five, 2-(Methyl((nonafluorobutyl)sulfonyl)amino)ethylacrylate has 0 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(Methyl((nonafluorobutyl)sulfonyl)amino)ethylacrylate is 67584-55-8.
The molecular formula of 2-(Methyl((nonafluorobutyl)sulfonyl)amino)ethylacrylate is C10H10F9NO4S.
The molecular weight of 2-(Methyl((nonafluorobutyl)sulfonyl)amino)ethylacrylate is 411.01868 g/mol.
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