1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene)
TL;DR: 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene) (CAS 312-30-1) is a chemical compound with molecular formula C12H6F2N2O6S and molecular weight 343.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-fluoro-4-(4-fluoro-3-nitrophenyl)sulfonyl-2-nitrobenzene
Also Known As: Bis(4-fluoro-3-nitrophenyl) sulfone, DNDS, Difluorodinitrobenzene sulfone, 4-Fluoro-3-nitrophenyl sulfone, DFDNPS
| Molecular Formula | C12H6F2N2O6S |
|---|---|
| Molecular Weight | 343.99 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.99146 |
| Heavy Atoms | 23 |
| Complexity | 526.0 |
Chemical Identifiers
| CAS Number | 312-30-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])[N+](=O)[O-])F |
| InChIKey | KHAWDEWNXJIVCJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene) (CAS 312-30-1), with molecular formula C12H6F2N2O6S and molecular weight 343.99 g/mol. IUPAC: 1-fluoro-4-(4-fluoro-3-nitrophenyl)sulfonyl-2-nitrobenzene.
Chemical Property Profile of 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene)
Property Insights of 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene)
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene). The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene). Following Lipinski's Rule of Five, 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene) has 0 hydrogen bond donor(s) and 8 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 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene)?
The CAS number of 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene) is 312-30-1.
What is the molecular formula of 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene)?
The molecular formula of 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene) is C12H6F2N2O6S.
What is the molecular weight of 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene)?
The molecular weight of 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene) is 343.99 g/mol.
Where can I buy 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene)?
You can request a quote for 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Sulfonylbis(4-fluoro-3-nitrobenzene) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.