1-(Butylsulfonyl)-4-chlorobenzene
TL;DR: 1-(Butylsulfonyl)-4-chlorobenzene (CAS 6344-43-0) 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.
1-butylsulfonyl-4-chlorobenzene
Also Known As: 1-(butylsulfonyl)-4-chlorobenzene, 1-butylsulfonyl-4-chlorobenzene, KST-1B8097, Benzene, 1-(butylsulfonyl)-4-chloro-, 1-(BUTANE-1-SULFONYL)-4-CHLOROBENZENE
| Molecular Formula | C10H13ClO2S |
|---|---|
| Molecular Weight | 232.03 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.03249 |
| Heavy Atoms | 14 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 6344-43-0 |
|---|---|
| SMILES | CCCCS(=O)(=O)C1=CC=C(C=C1)Cl |
| InChIKey | BNTDSRCIGYVKEO-UHFFFAOYSA-N |
Product Overview
1-(Butylsulfonyl)-4-chlorobenzene (CAS 6344-43-0), with molecular formula C10H13ClO2S and molecular weight 232.03 g/mol. IUPAC: 1-butylsulfonyl-4-chlorobenzene.
Chemical Property Profile of 1-(Butylsulfonyl)-4-chlorobenzene
Property Insights of 1-(Butylsulfonyl)-4-chlorobenzene
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Butylsulfonyl)-4-chlorobenzene. With a topological polar surface area (TPSA) of 42.5 Ų, 1-(Butylsulfonyl)-4-chlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Butylsulfonyl)-4-chlorobenzene 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-(Butylsulfonyl)-4-chlorobenzene?
The CAS number of 1-(Butylsulfonyl)-4-chlorobenzene is 6344-43-0.
What is the molecular formula of 1-(Butylsulfonyl)-4-chlorobenzene?
The molecular formula of 1-(Butylsulfonyl)-4-chlorobenzene is C10H13ClO2S.
What is the molecular weight of 1-(Butylsulfonyl)-4-chlorobenzene?
The molecular weight of 1-(Butylsulfonyl)-4-chlorobenzene is 232.03 g/mol.
Where can I buy 1-(Butylsulfonyl)-4-chlorobenzene?
You can request a quote for 1-(Butylsulfonyl)-4-chlorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Butylsulfonyl)-4-chlorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Butylsulfonyl)-4-chlorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.