![2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline structure](/static/products/1025/1025665-42-2.webp)
2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline
TL;DR: 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline (CAS 1025665-42-2) is a chemical compound with molecular formula C15H13FN2O4S and molecular weight 336.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-N-[2-(4-methylphenyl)sulfonyl-2-nitroethenyl]aniline
Also Known As: 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline, 1-NITRO-2-((2-FLUOROPHENYL)AMINO)-1-((4-METHYLPHENYL)SULFONYL)ETHENE, 2-fluoro-N-[2-(4-methylphenyl)sulfonyl-2-nitroethenyl]aniline, 2-fluoro-N-[2-(4-methylphenyl)sulfonyl-2-nitro-ethenyl]aniline
| Molecular Formula | C15H13FN2O4S |
|---|---|
| Molecular Weight | 336.06 g/mol |
| LogP | 3.09552 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.058 |
| Heavy Atoms | 23 |
| Complexity | 861.30054 |
Chemical Identifiers
| CAS Number | 1025665-42-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC=CC=C2F)[N+](=O)[O-] |
Product Overview
2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline (CAS 1025665-42-2), with molecular formula C15H13FN2O4S and molecular weight 336.06 g/mol. IUPAC: 2-fluoro-N-[2-(4-methylphenyl)sulfonyl-2-nitroethenyl]aniline.
Chemical Property Profile of 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline
Property Insights of 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline
The XLogP value of 3.09552 indicates that 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline. Following Lipinski's Rule of Five, 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline?
The CAS number of 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline is 1025665-42-2.
What is the molecular formula of 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline?
The molecular formula of 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline is C15H13FN2O4S.
What is the molecular weight of 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline?
The molecular weight of 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline is 336.06 g/mol.
Where can I buy 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline?
You can request a quote for 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.