![1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene structure](/static/products/3040/30406-61-2.webp)
1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene
TL;DR: 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene (CAS 30406-61-2) is a chemical compound with molecular formula C14H12Cl2O2S and molecular weight 313.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(benzenesulfonyl)-1-chloroethyl]-4-chlorobenzene
Also Known As: 1-chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene, 1-[2-(benzenesulfonyl)-1-chloroethyl]-4-chlorobenzene, Benzene,1-chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]-
| Molecular Formula | C14H12Cl2O2S |
|---|---|
| Molecular Weight | 313.99 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.9935 |
| Heavy Atoms | 19 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 30406-61-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)CC(C2=CC=C(C=C2)Cl)Cl |
| InChIKey | YMSYLSGXODZWTK-UHFFFAOYSA-N |
Product Overview
1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene (CAS 30406-61-2), with molecular formula C14H12Cl2O2S and molecular weight 313.99 g/mol. IUPAC: 1-[2-(benzenesulfonyl)-1-chloroethyl]-4-chlorobenzene.
Chemical Property Profile of 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene
Property Insights of 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene
The XLogP value of 3.0 indicates that 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene 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-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene?
The CAS number of 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene is 30406-61-2.
What is the molecular formula of 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene?
The molecular formula of 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene is C14H12Cl2O2S.
What is the molecular weight of 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene?
The molecular weight of 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene is 313.99 g/mol.
Where can I buy 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene?
You can request a quote for 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-4-[1-chloro-2-(phenylsulfonyl)ethyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.