TL;DR: RefChem:479178 (CAS 66008-67-1) is a chemical compound with molecular formula C19H12F25NO4S and molecular weight 825.0088 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[methyl(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-pentacosafluorotridecylsulfonyl)amino]ethyl prop-2-enoate
Also Known As: 2-(N-(1,1-Dihydroperfluorotridecylsulfonyl)-N-methylamino)ethyl acrylate, 2-[N-(1,1-Dihydroperfluorotridecylsulfonyl)-N-methylamino]ethyl acrylate, Acrylic acid, 2-(N-(1,1-dihydroperfluorotridecylsulfonyl)-N-methylamino)ethyl ester, 2-Propenoic acid, 2-(methyl((2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-pentacosafluorotridecyl)sulfonyl)amino)ethyl ester, 2-Propenoic acid, 2-[methyl[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-pentacosafluorotridecyl)sulfonyl]amino]ethyl ester
| Molecular Formula | C19H12F25NO4S |
| Molecular Weight | 825.0088 g/mol |
| XLogP | 8.5 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 30 |
| Rotatable Bonds | 18 |
| Exact Mass | 825.0088 Da |
| Heavy Atoms | 50 |
| Complexity | 1360.0 |
| SMILES | CN(CCOC(=O)C=C)S(=O)(=O)CC(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | NYDXNYWTPDRONX-UHFFFAOYSA-N |
The XLogP value of 8.5 indicates that RefChem:479178 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 RefChem:479178. Following Lipinski's Rule of Five, RefChem:479178 has 0 hydrogen bond donor(s) and 30 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:479178 is 66008-67-1.
The molecular formula of RefChem:479178 is C19H12F25NO4S.
The molecular weight of RefChem:479178 is 825.0088 g/mol.
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