![2-[(Ethylsulfanyl)methyl]phenol structure](/static/products/2076/20760-06-9.webp)
2-[(Ethylsulfanyl)methyl]phenol
TL;DR: 2-[(Ethylsulfanyl)methyl]phenol (CAS 20760-06-9) is a chemical compound with molecular formula C9H12OS and molecular weight 168.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(ethylsulfanylmethyl)phenol
Also Known As: 2-[(Ethylsulfanyl)methyl]phenol, Octicidine, alpha-(Ethylthio)-o-cresol, alpha- -o-cresol, 2-(ethylsulfanylmethyl)phenol
| Molecular Formula | C9H12OS |
|---|---|
| Molecular Weight | 168.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 168.06088 |
| Heavy Atoms | 11 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 20760-06-9 |
|---|---|
| SMILES | CCSCC1=CC=CC=C1O |
| InChIKey | QZBBPVLBIUUYRH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(Ethylsulfanyl)methyl]phenol (CAS 20760-06-9), with molecular formula C9H12OS and molecular weight 168.06 g/mol. IUPAC: 2-(ethylsulfanylmethyl)phenol.
Chemical Property Profile of 2-[(Ethylsulfanyl)methyl]phenol
Property Insights of 2-[(Ethylsulfanyl)methyl]phenol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(Ethylsulfanyl)methyl]phenol. With a topological polar surface area (TPSA) of 45.5 Ų, 2-[(Ethylsulfanyl)methyl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Ethylsulfanyl)methyl]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 2-[(Ethylsulfanyl)methyl]phenol?
The CAS number of 2-[(Ethylsulfanyl)methyl]phenol is 20760-06-9.
What is the molecular formula of 2-[(Ethylsulfanyl)methyl]phenol?
The molecular formula of 2-[(Ethylsulfanyl)methyl]phenol is C9H12OS.
What is the molecular weight of 2-[(Ethylsulfanyl)methyl]phenol?
The molecular weight of 2-[(Ethylsulfanyl)methyl]phenol is 168.06 g/mol.
Where can I buy 2-[(Ethylsulfanyl)methyl]phenol?
You can request a quote for 2-[(Ethylsulfanyl)methyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Ethylsulfanyl)methyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Ethylsulfanyl)methyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.