CTK5H9194
4-[(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-2-hydroxyundecyl)amino]-4-oxobut-2-enoic acid
Also Known As: EINECS 306-444-4|4-Oxo-4-[(3-(perfluorooctyl)-2-hydroxypropyl)amino]-(Z)-2-butenoic acid|4-OXO-4-[(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-HEPTADECAFLUORO-2-HYDROXYUNDECYL)AMINO]ISOCROTONIC ACID|4-Oxo-4-((4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-2-hydroxyundecyl)amino)isocrotonic acid
| Molecular Formula | C15H10F17NO4 |
|---|---|
| Molecular Weight | 591.0338 g/mol |
| LogP | 4.5038 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 591.0338 |
| Monoisotopic Mass | 591.0338 |
| Heavy Atoms | 37 |
| Complexity | 880.4139 |
Chemical Identifiers
| CAS Number | 97259-81-9 |
|---|---|
| SMILES | C(C(CNC(=O)C=CC(=O)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 |
Product Overview
CTK5H9194 (CAS 97259-81-9), with molecular formula C15H10F17NO4 and molecular weight 591.0338 g/mol. IUPAC: 4-[(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-2-hydroxyundecyl)amino]-4-oxobut-2-enoic acid.
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