1-Methanesulfonyl-4-methylsulfanyl-benzene
TL;DR: 1-Methanesulfonyl-4-methylsulfanyl-benzene (CAS 52323-93-0) is a chemical compound with molecular formula C8H10O2S2 and molecular weight 202.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfanyl-4-methylsulfonylbenzene
Also Known As: 1-Methanesulfonyl-4-methylsulfanyl-benzene, 1-methylsulfanyl-4-methylsulfonylbenzene, Methyl 4-(methylthio)phenyl sulfone, Methyl[4-(methylthio)phenyl] sulfone, 1-METHANESULFONYL-4-(METHYLSULFANYL)BENZENE
| Molecular Formula | C8H10O2S2 |
|---|---|
| Molecular Weight | 202.01 g/mol |
| LogP | 1.812 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.01222 |
| Heavy Atoms | 12 |
| Complexity | 351.14917 |
Chemical Identifiers
| CAS Number | 52323-93-0 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)S(=O)(=O)C |
Product Overview
1-Methanesulfonyl-4-methylsulfanyl-benzene (CAS 52323-93-0), with molecular formula C8H10O2S2 and molecular weight 202.01 g/mol. IUPAC: 1-methylsulfanyl-4-methylsulfonylbenzene.
Chemical Property Profile of 1-Methanesulfonyl-4-methylsulfanyl-benzene
Property Insights of 1-Methanesulfonyl-4-methylsulfanyl-benzene
The XLogP value of 1.812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methanesulfonyl-4-methylsulfanyl-benzene. With a topological polar surface area (TPSA) of 34.14 Ų, 1-Methanesulfonyl-4-methylsulfanyl-benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methanesulfonyl-4-methylsulfanyl-benzene has 0 hydrogen bond donor(s) and 3 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-Methanesulfonyl-4-methylsulfanyl-benzene?
The CAS number of 1-Methanesulfonyl-4-methylsulfanyl-benzene is 52323-93-0.
What is the molecular formula of 1-Methanesulfonyl-4-methylsulfanyl-benzene?
The molecular formula of 1-Methanesulfonyl-4-methylsulfanyl-benzene is C8H10O2S2.
What is the molecular weight of 1-Methanesulfonyl-4-methylsulfanyl-benzene?
The molecular weight of 1-Methanesulfonyl-4-methylsulfanyl-benzene is 202.01 g/mol.
Where can I buy 1-Methanesulfonyl-4-methylsulfanyl-benzene?
You can request a quote for 1-Methanesulfonyl-4-methylsulfanyl-benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methanesulfonyl-4-methylsulfanyl-benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Methanesulfonyl-4-methylsulfanyl-benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.