![2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid structure](/static/products/7478/7478-94-6.webp)
2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid
TL;DR: 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid (CAS 7478-94-6) is a chemical compound with molecular formula C11H14O4S and molecular weight 242.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(4-hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid
Also Known As: 2-[1-(4-hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid, {[1-(4-HYDROXY-3-METHOXYPHENYL)ETHYL]SULFANYL}ACETIC ACID
| Molecular Formula | C11H14O4S |
|---|---|
| Molecular Weight | 242.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 92.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.06128 |
| Heavy Atoms | 16 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 7478-94-6 |
|---|---|
| SMILES | CC(C1=CC(=C(C=C1)O)OC)SCC(=O)O |
| InChIKey | VYUXYRNDAZKAPL-UHFFFAOYSA-N |
Product Overview
2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid (CAS 7478-94-6), with molecular formula C11H14O4S and molecular weight 242.06 g/mol. IUPAC: 2-[1-(4-hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid.
Chemical Property Profile of 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid
Property Insights of 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid. The TPSA of 92.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid. Following Lipinski's Rule of Five, 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid has 2 hydrogen bond donor(s) and 5 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-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid?
The CAS number of 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid is 7478-94-6.
What is the molecular formula of 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid?
The molecular formula of 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid is C11H14O4S.
What is the molecular weight of 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid?
The molecular weight of 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid is 242.06 g/mol.
Where can I buy 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid?
You can request a quote for 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-(4-Hydroxy-3-methoxyphenyl)ethylsulfanyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.