4-Methylsulfanyl-1-phenylbut-3-en-1-ol
TL;DR: 4-Methylsulfanyl-1-phenylbut-3-en-1-ol (CAS 53634-77-8) is a chemical compound with molecular formula C11H14OS and molecular weight 194.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfanyl-1-phenylbut-3-en-1-ol
Also Known As: 4-(Methylthio)-1-phenyl-3-buten-1-ol
| Molecular Formula | C11H14OS |
|---|---|
| Molecular Weight | 194.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 194.07654 |
| Heavy Atoms | 13 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 53634-77-8 |
|---|---|
| SMILES | CSC=CCC(C1=CC=CC=C1)O |
| InChIKey | OOJGPFXVZORBJF-UHFFFAOYSA-N |
Product Overview
4-Methylsulfanyl-1-phenylbut-3-en-1-ol (CAS 53634-77-8), with molecular formula C11H14OS and molecular weight 194.08 g/mol. IUPAC: 4-methylsulfanyl-1-phenylbut-3-en-1-ol.
Chemical Property Profile of 4-Methylsulfanyl-1-phenylbut-3-en-1-ol
Property Insights of 4-Methylsulfanyl-1-phenylbut-3-en-1-ol
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methylsulfanyl-1-phenylbut-3-en-1-ol. With a topological polar surface area (TPSA) of 45.5 Ų, 4-Methylsulfanyl-1-phenylbut-3-en-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylsulfanyl-1-phenylbut-3-en-1-ol 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-Methylsulfanyl-1-phenylbut-3-en-1-ol?
The CAS number of 4-Methylsulfanyl-1-phenylbut-3-en-1-ol is 53634-77-8.
What is the molecular formula of 4-Methylsulfanyl-1-phenylbut-3-en-1-ol?
The molecular formula of 4-Methylsulfanyl-1-phenylbut-3-en-1-ol is C11H14OS.
What is the molecular weight of 4-Methylsulfanyl-1-phenylbut-3-en-1-ol?
The molecular weight of 4-Methylsulfanyl-1-phenylbut-3-en-1-ol is 194.08 g/mol.
Where can I buy 4-Methylsulfanyl-1-phenylbut-3-en-1-ol?
You can request a quote for 4-Methylsulfanyl-1-phenylbut-3-en-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylsulfanyl-1-phenylbut-3-en-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylsulfanyl-1-phenylbut-3-en-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.