[4-(Methylthio)phenoxy]acetic acid
TL;DR: [4-(Methylthio)phenoxy]acetic acid (CAS 15267-49-9) is a chemical compound with molecular formula C9H10O3S and molecular weight 198.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylsulfanylphenoxy)acetic acid
Also Known As: [4-(methylthio)phenoxy]acetic acid|2-(4-methylsulfanylphenoxy)acetic acid|2-(4-(Methylthio)phenoxy)acetic acid|2-[4-(methylsulfanyl)phenoxy]acetic acid|[4-(methylsulfanyl)phenoxy]acetic acid|4-(methylsulfanyl)phenoxyacetic acid|4-(Methylthio)phenoxyacetic acid|2-[4-(methylthio)phenoxy]Acetic acid|2-(4-(Methylthio)phenoxy)aceticacid|4744AD|AC4457|AG-664/25003434|4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)piperidine
| Molecular Formula | C9H10O3S |
|---|---|
| Molecular Weight | 198.04 g/mol |
| LogP | 1.8719 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 198.03506 |
| Heavy Atoms | 13 |
| Complexity | 281.41623 |
Chemical Identifiers
| CAS Number | 15267-49-9 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)OCC(=O)O |
Product Overview
[4-(Methylthio)phenoxy]acetic acid (CAS 15267-49-9), with molecular formula C9H10O3S and molecular weight 198.04 g/mol. IUPAC: 2-(4-methylsulfanylphenoxy)acetic acid.
Chemical Property Profile of [4-(Methylthio)phenoxy]acetic acid
Property Insights of [4-(Methylthio)phenoxy]acetic acid
The XLogP value of 1.8719 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(Methylthio)phenoxy]acetic acid. With a topological polar surface area (TPSA) of 46.53 Ų, [4-(Methylthio)phenoxy]acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(Methylthio)phenoxy]acetic acid has 1 hydrogen bond donor(s) and 3 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-(Methylthio)phenoxy]acetic acid?
The CAS number of [4-(Methylthio)phenoxy]acetic acid is 15267-49-9.
What is the molecular formula of [4-(Methylthio)phenoxy]acetic acid?
The molecular formula of [4-(Methylthio)phenoxy]acetic acid is C9H10O3S.
What is the molecular weight of [4-(Methylthio)phenoxy]acetic acid?
The molecular weight of [4-(Methylthio)phenoxy]acetic acid is 198.04 g/mol.
Where can I buy [4-(Methylthio)phenoxy]acetic acid?
You can request a quote for [4-(Methylthio)phenoxy]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(Methylthio)phenoxy]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [4-(Methylthio)phenoxy]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.