1-Chloroethylsulfonylbenzene
TL;DR: 1-Chloroethylsulfonylbenzene (CAS 13557-25-0) is a chemical compound with molecular formula C8H9ClO2S and molecular weight 204.00117 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloroethylsulfonylbenzene
Also Known As: 1-chloroethylsulfonylbenzene, 1-chloroethyl phenyl sulfone, (1-Chloroethyl)phenyl sulfone, (1-Chlor-aethyl)-phenyl-sulfon, (1-CHLOROETHANESULFONYL)BENZENE
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H9ClO2S |
| Molecular Weight | 204.00117 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.00117 Da |
| Heavy Atoms | 12 |
| Complexity | 224.0 |
| SMILES | CC(S(=O)(=O)C1=CC=CC=C1)Cl |
| InChIKey | CJHONDZWLQBAMB-UHFFFAOYSA-N |
Chemical Property Profile of 1-Chloroethylsulfonylbenzene
Property Insights of 1-Chloroethylsulfonylbenzene
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloroethylsulfonylbenzene. With a topological polar surface area (TPSA) of 42.5 Ų, 1-Chloroethylsulfonylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloroethylsulfonylbenzene 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
What is the CAS number of 1-Chloroethylsulfonylbenzene?
The CAS number of 1-Chloroethylsulfonylbenzene is 13557-25-0.
What is the molecular formula of 1-Chloroethylsulfonylbenzene?
The molecular formula of 1-Chloroethylsulfonylbenzene is C8H9ClO2S.
What is the molecular weight of 1-Chloroethylsulfonylbenzene?
The molecular weight of 1-Chloroethylsulfonylbenzene is 204.00117 g/mol.
Where can I buy 1-Chloroethylsulfonylbenzene?
You can request a quote for 1-Chloroethylsulfonylbenzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Chloroethylsulfonylbenzene?
Yes, CoreyChem provides custom synthesis services for 1-Chloroethylsulfonylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.