4-(2-Aminoethoxy)-4-oxobut-2-enoic acid
TL;DR: 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid (CAS 60461-84-9) is a chemical compound with molecular formula C6H9NO4 and molecular weight 159.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-aminoethoxy)-4-oxobut-2-enoic acid
Also Known As: 4-(2-aminoethoxy)-4-oxobut-2-enoic acid, 4-(2-aminoethoxy)-4-oxo-but-2-enoic acid
| Molecular Formula | C6H9NO4 |
|---|---|
| Molecular Weight | 159.05 g/mol |
| LogP | -3.3 |
| Topological Polar Surface Area | 89.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 159.05316 |
| Heavy Atoms | 11 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 60461-84-9 |
|---|---|
| SMILES | C(COC(=O)C=CC(=O)O)N |
| InChIKey | AMNZCNIIHBLRJO-UHFFFAOYSA-N |
Product Overview
4-(2-Aminoethoxy)-4-oxobut-2-enoic acid (CAS 60461-84-9), with molecular formula C6H9NO4 and molecular weight 159.05 g/mol. IUPAC: 4-(2-aminoethoxy)-4-oxobut-2-enoic acid.
Chemical Property Profile of 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid
Property Insights of 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid
The XLogP value of -3.3 indicates that 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid. Following Lipinski's Rule of Five, 4-(2-Aminoethoxy)-4-oxobut-2-enoic 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 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid?
The CAS number of 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid is 60461-84-9.
What is the molecular formula of 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid?
The molecular formula of 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid is C6H9NO4.
What is the molecular weight of 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid?
The molecular weight of 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid is 159.05 g/mol.
Where can I buy 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid?
You can request a quote for 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Aminoethoxy)-4-oxobut-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.