1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene
TL;DR: 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene (CAS 322-67-8) is a chemical compound with molecular formula C12H4F4N2O4S and molecular weight 347.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,5-difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene
Also Known As: bis-(4,5-difluoro-2-nitro-phenyl)-sulfide, 1-(4,5-difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene, 1,1'-Sulfanediylbis(4,5-difluoro-2-nitrobenzene)
| Molecular Formula | C12H4F4N2O4S |
|---|---|
| Molecular Weight | 347.98 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 347.9828 |
| Heavy Atoms | 23 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 322-67-8 |
|---|---|
| SMILES | C1=C(C(=CC(=C1F)F)SC2=CC(=C(C=C2[N+](=O)[O-])F)F)[N+](=O)[O-] |
| InChIKey | MBHVENYPYKOCNI-UHFFFAOYSA-N |
Product Overview
1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene (CAS 322-67-8), with molecular formula C12H4F4N2O4S and molecular weight 347.98 g/mol. IUPAC: 1-(4,5-difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene.
Chemical Property Profile of 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene
Property Insights of 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene
The XLogP value of 4.1 indicates that 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene. Following Lipinski's Rule of Five, 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene has 0 hydrogen bond donor(s) and 9 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-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene?
The CAS number of 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene is 322-67-8.
What is the molecular formula of 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene?
The molecular formula of 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene is C12H4F4N2O4S.
What is the molecular weight of 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene?
The molecular weight of 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene is 347.98 g/mol.
Where can I buy 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene?
You can request a quote for 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,5-Difluoro-2-nitrophenyl)sulfanyl-4,5-difluoro-2-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.