2-(4-Fluoro-2-nitrophenyl)sulfanylaniline
TL;DR: 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline (CAS 322-73-6) is a chemical compound with molecular formula C12H9FN2O2S and molecular weight 264.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluoro-2-nitrophenyl)sulfanylaniline
Also Known As: 2-(4-fluoro-2-nitrophenyl)sulfanylaniline, 2-(4-fluoro-2-nitrophenylthio)aniline, 2-[(4-Fluoro-2-nitrophenyl)sulfanyl]aniline
| Molecular Formula | C12H9FN2O2S |
|---|---|
| Molecular Weight | 264.04 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 97.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.03687 |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 322-73-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N)SC2=C(C=C(C=C2)F)[N+](=O)[O-] |
| InChIKey | UQWUSLRRVOVDDY-UHFFFAOYSA-N |
Product Overview
2-(4-Fluoro-2-nitrophenyl)sulfanylaniline (CAS 322-73-6), with molecular formula C12H9FN2O2S and molecular weight 264.04 g/mol. IUPAC: 2-(4-fluoro-2-nitrophenyl)sulfanylaniline.
Chemical Property Profile of 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline
Property Insights of 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline
The XLogP value of 3.2 indicates that 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline. Following Lipinski's Rule of Five, 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline 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-(4-Fluoro-2-nitrophenyl)sulfanylaniline?
The CAS number of 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline is 322-73-6.
What is the molecular formula of 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline?
The molecular formula of 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline is C12H9FN2O2S.
What is the molecular weight of 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline?
The molecular weight of 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline is 264.04 g/mol.
Where can I buy 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline?
You can request a quote for 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Fluoro-2-nitrophenyl)sulfanylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.