1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE
TL;DR: 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE (CAS 1025680-72-1) is a chemical compound with molecular formula C20H18F6N2O4S and molecular weight 496.08914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(4-tert-butylphenyl)sulfonyl-2-nitroethenyl]-3,5-bis(trifluoromethyl)aniline
Also Known As: 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE, N-[2-(4-tert-butylphenyl)sulfonyl-2-nitro-vinyl]-3,5-bis(trifluoromethyl)aniline, N-[2-(4-tert-butylphenyl)sulfonyl-2-nitroethenyl]-3,5-bis(trifluoromethyl)aniline, N-[2-nitro-2-(4-tert-butylphenyl)sulfonyl-ethenyl]-3,5-bis(trifluoromethyl)aniline, C20H18F6N2O4S
Technical Specifications
| Molecular Formula | C20H18F6N2O4S |
| Molecular Weight | 496.08914 g/mol |
| XLogP | 6.9 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 496.08914 Da |
| Heavy Atoms | 33 |
| Complexity | 807.0 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)[N+](=O)[O-] |
| InChIKey | QWSIHJOWAUEGAC-UHFFFAOYSA-N |
Chemical Property Profile of 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE
Property Insights of 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE
The XLogP value of 6.9 indicates that 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE. Following Lipinski's Rule of Five, 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE has 1 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 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE?
The CAS number of 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE is 1025680-72-1.
What is the molecular formula of 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE?
The molecular formula of 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE is C20H18F6N2O4S.
What is the molecular weight of 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE?
The molecular weight of 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE is 496.08914 g/mol.
Where can I buy 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE?
You can request a quote for 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE?
Yes, CoreyChem provides custom synthesis services for 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-NITROETHENE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.