1,2-Dichloro-4-methylsulfonylbenzene
TL;DR: 1,2-Dichloro-4-methylsulfonylbenzene (CAS 4874-30-0) is a chemical compound with molecular formula C7H6Cl2O2S and molecular weight 223.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dichloro-4-methylsulfonylbenzene
Also Known As: 1,2-dichloro-4-(methylsulfonyl)benzene, 1,2-dichloro-4-methylsulfonylbenzene, 3,4-dichlorophenyl methyl sulfone, 3,4-Dichlorophenylmethylsulfone, 1,2-Dichloro-4-(methylsulphonyl)benzene
| Molecular Formula | C7H6Cl2O2S |
|---|---|
| Molecular Weight | 223.95 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.94655 |
| Heavy Atoms | 12 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 4874-30-0 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC(=C(C=C1)Cl)Cl |
| InChIKey | DNWUINQASFDJJS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Dichloro-4-methylsulfonylbenzene (CAS 4874-30-0), with molecular formula C7H6Cl2O2S and molecular weight 223.95 g/mol. IUPAC: 1,2-dichloro-4-methylsulfonylbenzene.
Chemical Property Profile of 1,2-Dichloro-4-methylsulfonylbenzene
Property Insights of 1,2-Dichloro-4-methylsulfonylbenzene
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dichloro-4-methylsulfonylbenzene. With a topological polar surface area (TPSA) of 42.5 Ų, 1,2-Dichloro-4-methylsulfonylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dichloro-4-methylsulfonylbenzene 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 1,2-Dichloro-4-methylsulfonylbenzene?
The CAS number of 1,2-Dichloro-4-methylsulfonylbenzene is 4874-30-0.
What is the molecular formula of 1,2-Dichloro-4-methylsulfonylbenzene?
The molecular formula of 1,2-Dichloro-4-methylsulfonylbenzene is C7H6Cl2O2S.
What is the molecular weight of 1,2-Dichloro-4-methylsulfonylbenzene?
The molecular weight of 1,2-Dichloro-4-methylsulfonylbenzene is 223.95 g/mol.
Where can I buy 1,2-Dichloro-4-methylsulfonylbenzene?
You can request a quote for 1,2-Dichloro-4-methylsulfonylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dichloro-4-methylsulfonylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dichloro-4-methylsulfonylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.