4-(p-Chlorophenylthio)butanol
TL;DR: 4-(p-Chlorophenylthio)butanol (CAS 15446-08-9) is a chemical compound with molecular formula C10H13ClOS and molecular weight 216.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)sulfanylbutan-1-ol
Also Known As: 4-(p-Chlorophenylthio)butanol, 4-(p-Chlorophenyl)thio-1-butanol, 4-(P-Chlorophenylthio)-1-butanol, 4-((4-Chlorophenyl)thio)-1-butanol, 4-(4-chlorophenyl)sulfanylbutan-1-ol
| Molecular Formula | C10H13ClOS |
|---|---|
| Molecular Weight | 216.04 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 216.03757 |
| Heavy Atoms | 13 |
| Complexity | 124.0 |
Chemical Identifiers
| CAS Number | 15446-08-9 |
|---|---|
| SMILES | C1=CC(=CC=C1SCCCCO)Cl |
| InChIKey | QCOAGIKQNXMJSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(p-Chlorophenylthio)butanol (CAS 15446-08-9), with molecular formula C10H13ClOS and molecular weight 216.04 g/mol. IUPAC: 4-(4-chlorophenyl)sulfanylbutan-1-ol.
Chemical Property Profile of 4-(p-Chlorophenylthio)butanol
Property Insights of 4-(p-Chlorophenylthio)butanol
The XLogP value of 3.0 indicates that 4-(p-Chlorophenylthio)butanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.5 Ų, 4-(p-Chlorophenylthio)butanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(p-Chlorophenylthio)butanol has 1 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-(p-Chlorophenylthio)butanol?
The CAS number of 4-(p-Chlorophenylthio)butanol is 15446-08-9.
What is the molecular formula of 4-(p-Chlorophenylthio)butanol?
The molecular formula of 4-(p-Chlorophenylthio)butanol is C10H13ClOS.
What is the molecular weight of 4-(p-Chlorophenylthio)butanol?
The molecular weight of 4-(p-Chlorophenylthio)butanol is 216.04 g/mol.
Where can I buy 4-(p-Chlorophenylthio)butanol?
You can request a quote for 4-(p-Chlorophenylthio)butanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(p-Chlorophenylthio)butanol?
Yes, KEHONG BIO provides custom synthesis services for 4-(p-Chlorophenylthio)butanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.