![(E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile structure](/static/products/102/1025706-82-4.webp)
(E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile
TL;DR: (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile (CAS 1025706-82-4) is a chemical compound with molecular formula C22H20F6N2O3S and molecular weight 506.1099 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile
Also Known As: (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile, 2-((4-(TERT-BUTYL)PHENYL)SULFONYL)-3-((4-(2,2,2-TRIFLUORO-1-HYDROXY-1-(TRIFLUOROMETHYL)ETHYL)PHENYL)AMINO)PROP-2-ENENITRILE, (2E)-2-(4-tert-butylbenzenesulfonyl)-3-{[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]amino}prop-2-enenitrile, (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]anilino]prop-2-enenitrile, 2-Propenenitrile, 2-[[4-(1,1-dimethylethyl)phenyl]sulfonyl]-3-[[4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenyl]amino]-
Technical Specifications
| Molecular Formula | C22H20F6N2O3S |
| Molecular Weight | 506.1099 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 98.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 506.1099 Da |
| Heavy Atoms | 34 |
| Complexity | 876.0 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)/C(=C/NC2=CC=C(C=C2)C(C(F)(F)F)(C(F)(F)F)O)/C#N |
| InChIKey | RALYQAKSTYQXKQ-QGOAFFKASA-N |
Chemical Property Profile of (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile
Property Insights of (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile
The XLogP value of 6.2 indicates that (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile. Following Lipinski's Rule of Five, (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile?
The CAS number of (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile is 1025706-82-4.
What is the molecular formula of (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile?
The molecular formula of (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile is C22H20F6N2O3S.
What is the molecular weight of (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile?
The molecular weight of (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile is 506.1099 g/mol.
Where can I buy (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile?
You can request a quote for (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile?
Yes, CoreyChem provides custom synthesis services for (E)-2-(4-tert-butylphenyl)sulfonyl-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)anilino]prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.