Di-2,4-xylyl sulfone
TL;DR: Di-2,4-xylyl sulfone (CAS 5184-75-8) is a chemical compound with molecular formula C16H18O2S and molecular weight 274.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dimethylphenyl)sulfonyl-2,4-dimethylbenzene
Also Known As: 2,4-Dixylylsulfone, Dixylyl Sulfone, Di-2,4-xylyl sulphone, DI-2,4-XYLYL SULFONE, di-2,4-xylylsulphone
| Molecular Formula | C16H18O2S |
|---|---|
| Molecular Weight | 274.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.10275 |
| Heavy Atoms | 19 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 5184-75-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)C)C)C |
| InChIKey | CWZZFEROKOHBGT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Di-2,4-xylyl sulfone (CAS 5184-75-8), with molecular formula C16H18O2S and molecular weight 274.10 g/mol. IUPAC: 1-(2,4-dimethylphenyl)sulfonyl-2,4-dimethylbenzene.
Chemical Property Profile of Di-2,4-xylyl sulfone
Property Insights of Di-2,4-xylyl sulfone
The XLogP value of 4.1 indicates that Di-2,4-xylyl sulfone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, Di-2,4-xylyl sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Di-2,4-xylyl sulfone 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 Di-2,4-xylyl sulfone?
The CAS number of Di-2,4-xylyl sulfone is 5184-75-8.
What is the molecular formula of Di-2,4-xylyl sulfone?
The molecular formula of Di-2,4-xylyl sulfone is C16H18O2S.
What is the molecular weight of Di-2,4-xylyl sulfone?
The molecular weight of Di-2,4-xylyl sulfone is 274.10 g/mol.
Where can I buy Di-2,4-xylyl sulfone?
You can request a quote for Di-2,4-xylyl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di-2,4-xylyl sulfone?
Yes, KEHONG BIO provides custom synthesis services for Di-2,4-xylyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.