![Benzene, [1-chloro-2-(methylsulfonyl)ethyl]- structure](/static/products/603/6038-47-7.png)
Benzene, [1-chloro-2-(methylsulfonyl)ethyl]-
TL;DR: Benzene, [1-chloro-2-(methylsulfonyl)ethyl]- (CAS 6038-47-7) is a chemical compound with molecular formula C9H11ClO2S and molecular weight 218.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-chloro-2-methylsulfonylethyl)benzene
Also Known As: [1-Chloro-2-(methylsulfonyl)ethyl]benzene|(1-chloro-2-methylsulfonylethyl)benzene|1-Chlor-1-phenyl-2-methylsulfonylaethan|[1-Chloro-2-(methylsulfonyl)ethyl]benzene #|Benzene, [1-chloro-2-(methylsulfonyl)ethyl]-|JINARSWFVQASKN-UHFFFAOYSA-N
| Molecular Formula | C9H11ClO2S |
|---|---|
| Molecular Weight | 218.02 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.01683 |
| Heavy Atoms | 13 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 6038-47-7 |
|---|---|
| SMILES | CS(=O)(=O)CC(C1=CC=CC=C1)Cl |
| InChIKey | JINARSWFVQASKN-UHFFFAOYSA-N |
Product Overview
Benzene, [1-chloro-2-(methylsulfonyl)ethyl]- (CAS 6038-47-7), with molecular formula C9H11ClO2S and molecular weight 218.02 g/mol. IUPAC: (1-chloro-2-methylsulfonylethyl)benzene.
Chemical Property Profile of Benzene, [1-chloro-2-(methylsulfonyl)ethyl]-
Property Insights of Benzene, [1-chloro-2-(methylsulfonyl)ethyl]-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene, [1-chloro-2-(methylsulfonyl)ethyl]-. With a topological polar surface area (TPSA) of 42.5 Ų, Benzene, [1-chloro-2-(methylsulfonyl)ethyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, [1-chloro-2-(methylsulfonyl)ethyl]- 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 Benzene, [1-chloro-2-(methylsulfonyl)ethyl]-?
The CAS number of Benzene, [1-chloro-2-(methylsulfonyl)ethyl]- is 6038-47-7.
What is the molecular formula of Benzene, [1-chloro-2-(methylsulfonyl)ethyl]-?
The molecular formula of Benzene, [1-chloro-2-(methylsulfonyl)ethyl]- is C9H11ClO2S.
What is the molecular weight of Benzene, [1-chloro-2-(methylsulfonyl)ethyl]-?
The molecular weight of Benzene, [1-chloro-2-(methylsulfonyl)ethyl]- is 218.02 g/mol.
Where can I buy Benzene, [1-chloro-2-(methylsulfonyl)ethyl]-?
You can request a quote for Benzene, [1-chloro-2-(methylsulfonyl)ethyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, [1-chloro-2-(methylsulfonyl)ethyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, [1-chloro-2-(methylsulfonyl)ethyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.