2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene
TL;DR: 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene (CAS 790232-11-0) is a chemical compound with molecular formula C10H13ClO2S and molecular weight 232.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloroethylsulfonyl)-1,4-dimethylbenzene
Also Known As: 2-(2-chloroethanesulfonyl)-1,4-dimethylbenzene, 2-[(2-chloroethyl)sulfonyl]-1,4-dimethylbenzene, 2-(2-chloroethylsulfonyl)-1,4-dimethylbenzene, 2-(2-chloroethylsulfonyl)-1,4-dimethyl-benzene
| Molecular Formula | C10H13ClO2S |
|---|---|
| Molecular Weight | 232.03 g/mol |
| LogP | 2.31594 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.03249 |
| Heavy Atoms | 14 |
| Complexity | 423.74817 |
Chemical Identifiers
| CAS Number | 790232-11-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)S(=O)(=O)CCCl |
Product Overview
2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene (CAS 790232-11-0), with molecular formula C10H13ClO2S and molecular weight 232.03 g/mol. IUPAC: 2-(2-chloroethylsulfonyl)-1,4-dimethylbenzene.
Chemical Property Profile of 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene
Property Insights of 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene
The XLogP value of 2.31594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene. With a topological polar surface area (TPSA) of 34.14 Ų, 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene 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 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene?
The CAS number of 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene is 790232-11-0.
What is the molecular formula of 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene?
The molecular formula of 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene is C10H13ClO2S.
What is the molecular weight of 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene?
The molecular weight of 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene is 232.03 g/mol.
Where can I buy 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene?
You can request a quote for 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chloroethanesulfonyl)-1,4-dimethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.