Benzene, 1,1'-thiobis(2,6-dimethyl-
TL;DR: Benzene, 1,1'-thiobis(2,6-dimethyl- (CAS 52805-90-0) is a chemical compound with molecular formula C16H18S and molecular weight 242.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,6-dimethylphenyl)sulfanyl-1,3-dimethylbenzene
Also Known As: Benzene, 1,1'-thiobis(2,6-dimethyl-, Bis(2,6-dimethylphenyl) sulfide, Benzene,1,1'-thiobis[2,6-dimethyl-, 1,1 -Thiobis(2,6-dimethylbenzene), 2,2',6,6'-tetramethyldiphenyl sulfide
| Molecular Formula | C16H18S |
|---|---|
| Molecular Weight | 242.11 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.11292 |
| Heavy Atoms | 17 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 52805-90-0 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)SC2=C(C=CC=C2C)C |
| InChIKey | JLGIRMVCNXRIMN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1,1'-thiobis(2,6-dimethyl- (CAS 52805-90-0), with molecular formula C16H18S and molecular weight 242.11 g/mol. IUPAC: 2-(2,6-dimethylphenyl)sulfanyl-1,3-dimethylbenzene.
Chemical Property Profile of Benzene, 1,1'-thiobis(2,6-dimethyl-
Property Insights of Benzene, 1,1'-thiobis(2,6-dimethyl-
The XLogP value of 5.4 indicates that Benzene, 1,1'-thiobis(2,6-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Benzene, 1,1'-thiobis(2,6-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1,1'-thiobis(2,6-dimethyl- has 0 hydrogen bond donor(s) and 1 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(2,6-dimethyl-?
The CAS number of Benzene, 1,1'-thiobis(2,6-dimethyl- is 52805-90-0.
What is the molecular formula of Benzene, 1,1'-thiobis(2,6-dimethyl-?
The molecular formula of Benzene, 1,1'-thiobis(2,6-dimethyl- is C16H18S.
What is the molecular weight of Benzene, 1,1'-thiobis(2,6-dimethyl-?
The molecular weight of Benzene, 1,1'-thiobis(2,6-dimethyl- is 242.11 g/mol.
Where can I buy Benzene, 1,1'-thiobis(2,6-dimethyl-?
You can request a quote for Benzene, 1,1'-thiobis(2,6-dimethyl- 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(2,6-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1,1'-thiobis(2,6-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.