1,4-Bis(methylsulfonylsulfanylmethyl)benzene
TL;DR: 1,4-Bis(methylsulfonylsulfanylmethyl)benzene (CAS 3948-46-7) is a chemical compound with molecular formula C10H14O4S4 and molecular weight 325.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis(methylsulfonylsulfanylmethyl)benzene
Also Known As: 1,4-bis(methylsulfonylsulfanylmethyl)benzene, alpha,alpha'-Paraxylyl Bismethanethiosulfonate, a,a'-Paraxylyl Bismethanethiosulfonate, ?,?'-Paraxylyl Bismethanethiosulfonate, A,
| Molecular Formula | C10H14O4S4 |
|---|---|
| Molecular Weight | 325.98 g/mol |
| LogP | 2.0722 |
| Topological Polar Surface Area | 68.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 325.9775 |
| Heavy Atoms | 18 |
| Complexity | 532.2698 |
Chemical Identifiers
| CAS Number | 3948-46-7 |
|---|---|
| SMILES | CS(=O)(=O)SCC1=CC=C(C=C1)CSS(=O)(=O)C |
Product Overview
1,4-Bis(methylsulfonylsulfanylmethyl)benzene (CAS 3948-46-7), with molecular formula C10H14O4S4 and molecular weight 325.98 g/mol. IUPAC: 1,4-bis(methylsulfonylsulfanylmethyl)benzene.
Chemical Property Profile of 1,4-Bis(methylsulfonylsulfanylmethyl)benzene
Property Insights of 1,4-Bis(methylsulfonylsulfanylmethyl)benzene
The XLogP value of 2.0722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Bis(methylsulfonylsulfanylmethyl)benzene. The TPSA of 68.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Bis(methylsulfonylsulfanylmethyl)benzene. Following Lipinski's Rule of Five, 1,4-Bis(methylsulfonylsulfanylmethyl)benzene has 0 hydrogen bond donor(s) and 6 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(methylsulfonylsulfanylmethyl)benzene?
The CAS number of 1,4-Bis(methylsulfonylsulfanylmethyl)benzene is 3948-46-7.
What is the molecular formula of 1,4-Bis(methylsulfonylsulfanylmethyl)benzene?
The molecular formula of 1,4-Bis(methylsulfonylsulfanylmethyl)benzene is C10H14O4S4.
What is the molecular weight of 1,4-Bis(methylsulfonylsulfanylmethyl)benzene?
The molecular weight of 1,4-Bis(methylsulfonylsulfanylmethyl)benzene is 325.98 g/mol.
Where can I buy 1,4-Bis(methylsulfonylsulfanylmethyl)benzene?
You can request a quote for 1,4-Bis(methylsulfonylsulfanylmethyl)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(methylsulfonylsulfanylmethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis(methylsulfonylsulfanylmethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.