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2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE structure
Fine Chemical

2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE

TL;DR: 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE (CAS 1025617-12-2) is a chemical compound with molecular formula C16H9BrF6N2O4S and molecular weight 517.9371 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[2-(4-bromophenyl)sulfonyl-2-nitroethenyl]-3,5-bis(trifluoromethyl)aniline

Also Known As: 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE, N-[2-(4-bromobenzenesulfonyl)-2-nitroethenyl]-3,5-bis(trifluoromethyl)aniline, N-[2-(4-bromophenyl)sulfonyl-2-nitro-ethenyl]-3,5-bis(trifluoromethyl)aniline, N-[2-(4-bromophenyl)sulfonyl-2-nitro-vinyl]-3,5-bis(trifluoromethyl)aniline, N-[2-(4-bromophenyl)sulfonyl-2-nitroethenyl]-3,5-bis(trifluoromethyl)aniline

CAS Number
1025617-12-2
Molecular Formula
C16H9BrF6N2O4S
Molecular Weight
517.9371 g/mol
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Technical Specifications

Molecular FormulaC16H9BrF6N2O4S
Molecular Weight517.9371 g/mol
XLogP5.9
Topological Polar Surface Area (TPSA)100.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors11
Rotatable Bonds4
Exact Mass517.9371 Da
Heavy Atoms30
Complexity730.0
SMILESC1=CC(=CC=C1S(=O)(=O)C(=CNC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)[N+](=O)[O-])Br
InChIKeyBGRMPJYPWAZAGF-UHFFFAOYSA-N

Chemical Property Profile of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE

XLogP
5.9
TPSA (Topological Polar Surface Area)
100.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
11
Rotatable Bonds
4
Heavy Atoms
30
Complexity
730.0
Exact Mass
517.9371
Monoisotopic Mass
517.9371
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE

The XLogP value of 5.9 indicates that 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-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 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE. Following Lipinski's Rule of Five, 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-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 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE?

The CAS number of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE is 1025617-12-2.

What is the molecular formula of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE?

The molecular formula of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE is C16H9BrF6N2O4S.

What is the molecular weight of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE?

The molecular weight of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE is 517.9371 g/mol.

Where can I buy 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE?

You can request a quote for 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE?

Yes, CoreyChem provides custom synthesis services for 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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