Benzene, 1,1'-thiobis[4-(methylthio)-
TL;DR: Benzene, 1,1'-thiobis[4-(methylthio)- (CAS 125877-23-8) is a chemical compound with molecular formula C14H14S3 and molecular weight 278.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfanyl-4-(4-methylsulfanylphenyl)sulfanylbenzene
Also Known As: ChemDiv3_000147, Benzene, 1,1'-thiobis[4-(methylthio)-, Bis[4-(methylthio)phenyl] sulfide, Bis-(4-methylmercapto-phenyl)-sulfid, IDI1_019465
| Molecular Formula | C14H14S3 |
|---|---|
| Molecular Weight | 278.03 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.02576 |
| Heavy Atoms | 17 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 125877-23-8 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)SC2=CC=C(C=C2)SC |
| InChIKey | GQUSUMUJMZGXSS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1,1'-thiobis[4-(methylthio)- (CAS 125877-23-8), with molecular formula C14H14S3 and molecular weight 278.03 g/mol. IUPAC: 1-methylsulfanyl-4-(4-methylsulfanylphenyl)sulfanylbenzene.
Chemical Property Profile of Benzene, 1,1'-thiobis[4-(methylthio)-
Property Insights of Benzene, 1,1'-thiobis[4-(methylthio)-
The XLogP value of 5.1 indicates that Benzene, 1,1'-thiobis[4-(methylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene, 1,1'-thiobis[4-(methylthio)-. Following Lipinski's Rule of Five, Benzene, 1,1'-thiobis[4-(methylthio)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, 1,1'-thiobis[4-(methylthio)-?
The CAS number of Benzene, 1,1'-thiobis[4-(methylthio)- is 125877-23-8.
What is the molecular formula of Benzene, 1,1'-thiobis[4-(methylthio)-?
The molecular formula of Benzene, 1,1'-thiobis[4-(methylthio)- is C14H14S3.
What is the molecular weight of Benzene, 1,1'-thiobis[4-(methylthio)-?
The molecular weight of Benzene, 1,1'-thiobis[4-(methylthio)- is 278.03 g/mol.
Where can I buy Benzene, 1,1'-thiobis[4-(methylthio)-?
You can request a quote for Benzene, 1,1'-thiobis[4-(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1,1'-thiobis[4-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1,1'-thiobis[4-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.