TL;DR: RefChem:480054 (CAS 61577-14-8) is a chemical compound with molecular formula C17H16F17NO4S and molecular weight 653.05286 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl(methyl)amino]butyl 2-methylprop-2-enoate
Also Known As: 4-[[sulphonyl]methylamino]butylmethacrylate, 4-(((Heptadecafluorooctyl)sulphonyl)methylamino)butyl methacrylate, 4-[[ sulphonyl]methylamino]butylmethacrylate, 4-(((Heptadecafluorooctyl)sulfonyl)methylamino)butyl methacrylate, 4-[[(HEPTADECAFLUOROOCTYL)SULFONYL]METHYLAMINO]BUTYL METHACRYLATE
| Molecular Formula | C17H16F17NO4S |
| Molecular Weight | 653.05286 g/mol |
| XLogP | 7.0 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 15 |
| Exact Mass | 653.05286 Da |
| Heavy Atoms | 40 |
| Complexity | 1050.0 |
| SMILES | CC(=C)C(=O)OCCCCN(C)S(=O)(=O)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 |
| InChIKey | DJKGXDGHCIHDPZ-UHFFFAOYSA-N |
The XLogP value of 7.0 indicates that RefChem:480054 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:480054. Following Lipinski's Rule of Five, RefChem:480054 has 0 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:480054 is 61577-14-8.
The molecular formula of RefChem:480054 is C17H16F17NO4S.
The molecular weight of RefChem:480054 is 653.05286 g/mol.
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