4-Allylsulfanyl-phenol
TL;DR: 4-Allylsulfanyl-phenol (CAS 5656-44-0) is a chemical compound with molecular formula C9H10OS and molecular weight 166.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-prop-2-enylsulfanylphenol
Also Known As: 4-allythiophenol, 4-ALLYLSULFANYL-PHENOL, 4-prop-2-enylsulfanylphenol, 4-(Allylthio)phenol, (R)-(-)-4-Phenyl-2-butanol
| Molecular Formula | C9H10OS |
|---|---|
| Molecular Weight | 166.05 g/mol |
| LogP | 2.6703 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.04524 |
| Heavy Atoms | 11 |
| Complexity | 227.82298 |
Chemical Identifiers
| CAS Number | 5656-44-0 |
|---|---|
| SMILES | C=CCSC1=CC=C(C=C1)O |
Product Overview
4-Allylsulfanyl-phenol (CAS 5656-44-0), with molecular formula C9H10OS and molecular weight 166.05 g/mol. IUPAC: 4-prop-2-enylsulfanylphenol.
Chemical Property Profile of 4-Allylsulfanyl-phenol
Property Insights of 4-Allylsulfanyl-phenol
The XLogP value of 2.6703 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Allylsulfanyl-phenol. With a topological polar surface area (TPSA) of 20.23 Ų, 4-Allylsulfanyl-phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Allylsulfanyl-phenol 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-Allylsulfanyl-phenol?
The CAS number of 4-Allylsulfanyl-phenol is 5656-44-0.
What is the molecular formula of 4-Allylsulfanyl-phenol?
The molecular formula of 4-Allylsulfanyl-phenol is C9H10OS.
What is the molecular weight of 4-Allylsulfanyl-phenol?
The molecular weight of 4-Allylsulfanyl-phenol is 166.05 g/mol.
Where can I buy 4-Allylsulfanyl-phenol?
You can request a quote for 4-Allylsulfanyl-phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Allylsulfanyl-phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Allylsulfanyl-phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.