Benzene, 1,1'-thiobis[4-nitro-
TL;DR: Benzene, 1,1'-thiobis[4-nitro- (CAS 1223-31-0) is a chemical compound with molecular formula C12H8N2O4S and molecular weight 276.02048 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-nitro-4-(4-nitrophenyl)sulfanylbenzene
Also Known As: Bis(4-nitrophenyl) Sulfide, Bis(4-nitrophenyl)sulfide, 4-Nitrophenyl sulfide, Bis(p-nitrophenyl)sulfide, 4,4'-Dinitrodiphenyl sulfide
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H8N2O4S |
| Molecular Weight | 276.02048 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.02048 Da |
| Heavy Atoms | 19 |
| Complexity | 294.0 |
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])SC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | ZZTJMQPRKBNGNX-UHFFFAOYSA-N |
Chemical Property Profile of Benzene, 1,1'-thiobis[4-nitro-
Property Insights of Benzene, 1,1'-thiobis[4-nitro-
The XLogP value of 3.5 indicates that Benzene, 1,1'-thiobis[4-nitro- 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 Benzene, 1,1'-thiobis[4-nitro-. Following Lipinski's Rule of Five, Benzene, 1,1'-thiobis[4-nitro- has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzene, 1,1'-thiobis[4-nitro-?
The CAS number of Benzene, 1,1'-thiobis[4-nitro- is 1223-31-0.
What is the molecular formula of Benzene, 1,1'-thiobis[4-nitro-?
The molecular formula of Benzene, 1,1'-thiobis[4-nitro- is C12H8N2O4S.
What is the molecular weight of Benzene, 1,1'-thiobis[4-nitro-?
The molecular weight of Benzene, 1,1'-thiobis[4-nitro- is 276.02048 g/mol.
Where can I buy Benzene, 1,1'-thiobis[4-nitro-?
You can request a quote for Benzene, 1,1'-thiobis[4-nitro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzene, 1,1'-thiobis[4-nitro-?
Yes, CoreyChem provides custom synthesis services for Benzene, 1,1'-thiobis[4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.