1,4-Bis(tert-butylsulfanyl)benzene
TL;DR: 1,4-Bis(tert-butylsulfanyl)benzene (CAS 25752-95-8) is a chemical compound with molecular formula C14H22S2 and molecular weight 254.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis(tert-butylsulfanyl)benzene
Also Known As: 1,4-bis(tert-butylsulfanyl)benzene, 1,4-bis(tert-butylthio)benzene, 1,4-Bis-(t-butylthio)-benzol, Benzene, 1,4-bis[(1,1-dimethylethyl)thio]-, 1,4-Bis-tert-butylsulfanyl-benzene
| Molecular Formula | C14H22S2 |
|---|---|
| Molecular Weight | 254.12 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.11629 |
| Heavy Atoms | 16 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 25752-95-8 |
|---|---|
| SMILES | CC(C)(C)SC1=CC=C(C=C1)SC(C)(C)C |
| InChIKey | ZLBRWPOMYZBQSI-UHFFFAOYSA-N |
Product Overview
1,4-Bis(tert-butylsulfanyl)benzene (CAS 25752-95-8), with molecular formula C14H22S2 and molecular weight 254.12 g/mol. IUPAC: 1,4-bis(tert-butylsulfanyl)benzene.
Chemical Property Profile of 1,4-Bis(tert-butylsulfanyl)benzene
Property Insights of 1,4-Bis(tert-butylsulfanyl)benzene
The XLogP value of 4.9 indicates that 1,4-Bis(tert-butylsulfanyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, 1,4-Bis(tert-butylsulfanyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Bis(tert-butylsulfanyl)benzene has 0 hydrogen bond donor(s) and 2 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-Bis(tert-butylsulfanyl)benzene?
The CAS number of 1,4-Bis(tert-butylsulfanyl)benzene is 25752-95-8.
What is the molecular formula of 1,4-Bis(tert-butylsulfanyl)benzene?
The molecular formula of 1,4-Bis(tert-butylsulfanyl)benzene is C14H22S2.
What is the molecular weight of 1,4-Bis(tert-butylsulfanyl)benzene?
The molecular weight of 1,4-Bis(tert-butylsulfanyl)benzene is 254.12 g/mol.
Where can I buy 1,4-Bis(tert-butylsulfanyl)benzene?
You can request a quote for 1,4-Bis(tert-butylsulfanyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis(tert-butylsulfanyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis(tert-butylsulfanyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.