1-Methoxy-2,4-bis(methylsulfonyl)benzene
TL;DR: 1-Methoxy-2,4-bis(methylsulfonyl)benzene (CAS 17481-99-1) is a chemical compound with molecular formula C9H12O5S2 and molecular weight 264.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-2,4-bis(methylsulfonyl)benzene
Also Known As: 1-methoxy-2,4-bis(methylsulfonyl)benzene, 2,4-Di(methanesulfonyl)-1-methoxybenzene, Benzene, 1-methoxy-2,4-bis(methylsulfonyl)-
| Molecular Formula | C9H12O5S2 |
|---|---|
| Molecular Weight | 264.01 g/mol |
| LogP | 0.5022 |
| Topological Polar Surface Area | 77.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.0126 |
| Heavy Atoms | 16 |
| Complexity | 598.78656 |
Chemical Identifiers
| CAS Number | 17481-99-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)C)S(=O)(=O)C |
Product Overview
1-Methoxy-2,4-bis(methylsulfonyl)benzene (CAS 17481-99-1), with molecular formula C9H12O5S2 and molecular weight 264.01 g/mol. IUPAC: 1-methoxy-2,4-bis(methylsulfonyl)benzene.
Chemical Property Profile of 1-Methoxy-2,4-bis(methylsulfonyl)benzene
Property Insights of 1-Methoxy-2,4-bis(methylsulfonyl)benzene
The XLogP value of 0.5022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methoxy-2,4-bis(methylsulfonyl)benzene. The TPSA of 77.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methoxy-2,4-bis(methylsulfonyl)benzene. Following Lipinski's Rule of Five, 1-Methoxy-2,4-bis(methylsulfonyl)benzene has 0 hydrogen bond donor(s) and 5 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-Methoxy-2,4-bis(methylsulfonyl)benzene?
The CAS number of 1-Methoxy-2,4-bis(methylsulfonyl)benzene is 17481-99-1.
What is the molecular formula of 1-Methoxy-2,4-bis(methylsulfonyl)benzene?
The molecular formula of 1-Methoxy-2,4-bis(methylsulfonyl)benzene is C9H12O5S2.
What is the molecular weight of 1-Methoxy-2,4-bis(methylsulfonyl)benzene?
The molecular weight of 1-Methoxy-2,4-bis(methylsulfonyl)benzene is 264.01 g/mol.
Where can I buy 1-Methoxy-2,4-bis(methylsulfonyl)benzene?
You can request a quote for 1-Methoxy-2,4-bis(methylsulfonyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methoxy-2,4-bis(methylsulfonyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Methoxy-2,4-bis(methylsulfonyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.