![(3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate structure](/static/products/4125/4125-93-3.webp)
(3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate
TL;DR: (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate (CAS 4125-93-3) is a chemical compound with molecular formula C8H15NO4 and molecular weight 189.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate
Also Known As: (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate
| Molecular Formula | C8H15NO4 |
|---|---|
| Molecular Weight | 189.10 g/mol |
| LogP | -1.9214 |
| Topological Polar Surface Area | 94.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 189.10011 |
| Heavy Atoms | 13 |
| Complexity | 206.6798 |
Chemical Identifiers
| CAS Number | 4125-93-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)[C@H](CC(=O)[O-])[NH3+] |
Product Overview
(3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate (CAS 4125-93-3), with molecular formula C8H15NO4 and molecular weight 189.10 g/mol. IUPAC: (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate.
Chemical Property Profile of (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate
Property Insights of (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate
The XLogP value of -1.9214 indicates that (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 94.07 Ų falls within the moderate polarity range, balancing permeability and solubility for (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate. Following Lipinski's Rule of Five, (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate has 1 hydrogen bond donor(s) and 4 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 (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate?
The CAS number of (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate is 4125-93-3.
What is the molecular formula of (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate?
The molecular formula of (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate is C8H15NO4.
What is the molecular weight of (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate?
The molecular weight of (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate is 189.10 g/mol.
Where can I buy (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate?
You can request a quote for (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for (3S)-3-azaniumyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.