4-t-Amylbenzenesulphonyl chloride
TL;DR: 4-t-Amylbenzenesulphonyl chloride (CAS 73948-18-2) is a chemical compound with molecular formula C11H15ClO2S and molecular weight 246.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-pentylbenzenesulfonyl chloride
Also Known As: 4-PENTYLBENZENE-1-SULFONYL CHLORIDE, 4-pentylbenzenesulfonyl Chloride, 4-n-Pentylbenzenesulfonyl chloride, 4-(n-pentyl)benzenesulfonyl chloride, 4-t-Amylbenzenesulphonyl chloride
| Molecular Formula | C11H15ClO2S |
|---|---|
| Molecular Weight | 246.05 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.04813 |
| Heavy Atoms | 15 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 73948-18-2 |
|---|---|
| SMILES | CCCCCC1=CC=C(C=C1)S(=O)(=O)Cl |
| InChIKey | XDWXZRVWJHEWMT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-t-Amylbenzenesulphonyl chloride (CAS 73948-18-2), with molecular formula C11H15ClO2S and molecular weight 246.05 g/mol. IUPAC: 4-pentylbenzenesulfonyl chloride.
Chemical Property Profile of 4-t-Amylbenzenesulphonyl chloride
Property Insights of 4-t-Amylbenzenesulphonyl chloride
The XLogP value of 4.4 indicates that 4-t-Amylbenzenesulphonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, 4-t-Amylbenzenesulphonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-t-Amylbenzenesulphonyl chloride 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 4-t-Amylbenzenesulphonyl chloride?
The CAS number of 4-t-Amylbenzenesulphonyl chloride is 73948-18-2.
What is the molecular formula of 4-t-Amylbenzenesulphonyl chloride?
The molecular formula of 4-t-Amylbenzenesulphonyl chloride is C11H15ClO2S.
What is the molecular weight of 4-t-Amylbenzenesulphonyl chloride?
The molecular weight of 4-t-Amylbenzenesulphonyl chloride is 246.05 g/mol.
Where can I buy 4-t-Amylbenzenesulphonyl chloride?
You can request a quote for 4-t-Amylbenzenesulphonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-t-Amylbenzenesulphonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-t-Amylbenzenesulphonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.