2-(Aminooxy)-4-(methylthio)butyric acid
TL;DR: 2-(Aminooxy)-4-(methylthio)butyric acid (CAS 54533-39-0) is a chemical compound with molecular formula C5H11NO3S and molecular weight 165.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminooxy-4-methylsulfanylbutanoic acid
Also Known As: 2-(Aminooxy)-4-(methylthio)butyric acid, 2-aminooxy-4-methylsulfanylbutanoic acid, 2-(Aminooxy)-4-(methylsulfanyl)butanoic acid, Butanoic acid, 2-(aminooxy)-4-(methylthio)-, 2-(Aminooxy)-4-(methylsulfanyl)butanoic acid #
| Molecular Formula | C5H11NO3S |
|---|---|
| Molecular Weight | 165.05 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 97.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 165.04596 |
| Heavy Atoms | 10 |
| Complexity | 109.0 |
Chemical Identifiers
| CAS Number | 54533-39-0 |
|---|---|
| SMILES | CSCCC(C(=O)O)ON |
| InChIKey | HPLQZHNLNSWRLR-UHFFFAOYSA-N |
Product Overview
2-(Aminooxy)-4-(methylthio)butyric acid (CAS 54533-39-0), with molecular formula C5H11NO3S and molecular weight 165.05 g/mol. IUPAC: 2-aminooxy-4-methylsulfanylbutanoic acid.
Chemical Property Profile of 2-(Aminooxy)-4-(methylthio)butyric acid
Property Insights of 2-(Aminooxy)-4-(methylthio)butyric acid
The XLogP value of -2.3 indicates that 2-(Aminooxy)-4-(methylthio)butyric acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Aminooxy)-4-(methylthio)butyric acid. Following Lipinski's Rule of Five, 2-(Aminooxy)-4-(methylthio)butyric 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-(Aminooxy)-4-(methylthio)butyric acid?
The CAS number of 2-(Aminooxy)-4-(methylthio)butyric acid is 54533-39-0.
What is the molecular formula of 2-(Aminooxy)-4-(methylthio)butyric acid?
The molecular formula of 2-(Aminooxy)-4-(methylthio)butyric acid is C5H11NO3S.
What is the molecular weight of 2-(Aminooxy)-4-(methylthio)butyric acid?
The molecular weight of 2-(Aminooxy)-4-(methylthio)butyric acid is 165.05 g/mol.
Where can I buy 2-(Aminooxy)-4-(methylthio)butyric acid?
You can request a quote for 2-(Aminooxy)-4-(methylthio)butyric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Aminooxy)-4-(methylthio)butyric acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Aminooxy)-4-(methylthio)butyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.