2-(Benzylsulfanyl)-1-phenylethanol
TL;DR: 2-(Benzylsulfanyl)-1-phenylethanol (CAS 838-67-5) is a chemical compound with molecular formula C15H16OS and molecular weight 244.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-1-phenylethanol
Also Known As: 2-(benzylsulfanyl)-1-phenylethanol, 2-benzylsulfanyl-1-phenylethanol, 1-Phenyl-2-(benzylthio)ethanol, 2-Benzylsulfanyl-1-phenyl-ethanol, 2-(benzylsulfanyl)-1-phenylethan-1-ol
| Molecular Formula | C15H16OS |
|---|---|
| Molecular Weight | 244.09 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 244.0922 |
| Heavy Atoms | 17 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 838-67-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSCC(C2=CC=CC=C2)O |
| InChIKey | PZFGUDPQZCBTGY-UHFFFAOYSA-N |
Product Overview
2-(Benzylsulfanyl)-1-phenylethanol (CAS 838-67-5), with molecular formula C15H16OS and molecular weight 244.09 g/mol. IUPAC: 2-benzylsulfanyl-1-phenylethanol.
Chemical Property Profile of 2-(Benzylsulfanyl)-1-phenylethanol
Property Insights of 2-(Benzylsulfanyl)-1-phenylethanol
The XLogP value of 3.2 indicates that 2-(Benzylsulfanyl)-1-phenylethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.5 Ų, 2-(Benzylsulfanyl)-1-phenylethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Benzylsulfanyl)-1-phenylethanol 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 2-(Benzylsulfanyl)-1-phenylethanol?
The CAS number of 2-(Benzylsulfanyl)-1-phenylethanol is 838-67-5.
What is the molecular formula of 2-(Benzylsulfanyl)-1-phenylethanol?
The molecular formula of 2-(Benzylsulfanyl)-1-phenylethanol is C15H16OS.
What is the molecular weight of 2-(Benzylsulfanyl)-1-phenylethanol?
The molecular weight of 2-(Benzylsulfanyl)-1-phenylethanol is 244.09 g/mol.
Where can I buy 2-(Benzylsulfanyl)-1-phenylethanol?
You can request a quote for 2-(Benzylsulfanyl)-1-phenylethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzylsulfanyl)-1-phenylethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzylsulfanyl)-1-phenylethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.