4-Morpholin-4-yl-4-oxobut-2-enoic acid
TL;DR: 4-Morpholin-4-yl-4-oxobut-2-enoic acid (CAS 52736-33-1) is a chemical compound with molecular formula C8H11NO4 and molecular weight 185.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-morpholin-4-yl-4-oxobut-2-enoic acid
Also Known As: 4-(morpholin-4-yl)-4-oxobut-2-enoic acid, 4-morpholin-4-yl-4-oxobut-2-enoic acid, (E)-4-morpholin-4-yl-4-oxobut-2-enoic acid, (Z)-4-morpholin-4-yl-4-oxobut-2-enoic acid, (2E)-4-morpholin-4-yl-4-oxobut-2-enoic acid
| Molecular Formula | C8H11NO4 |
|---|---|
| Molecular Weight | 185.07 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.0688 |
| Heavy Atoms | 13 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 52736-33-1 |
|---|---|
| SMILES | C1COCCN1C(=O)C=CC(=O)O |
| InChIKey | FCTFTKXWJQFGLI-UHFFFAOYSA-N |
Product Overview
4-Morpholin-4-yl-4-oxobut-2-enoic acid (CAS 52736-33-1), with molecular formula C8H11NO4 and molecular weight 185.07 g/mol. IUPAC: 4-morpholin-4-yl-4-oxobut-2-enoic acid.
Chemical Property Profile of 4-Morpholin-4-yl-4-oxobut-2-enoic acid
Property Insights of 4-Morpholin-4-yl-4-oxobut-2-enoic acid
The XLogP value of -0.9 indicates that 4-Morpholin-4-yl-4-oxobut-2-enoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Morpholin-4-yl-4-oxobut-2-enoic acid. Following Lipinski's Rule of Five, 4-Morpholin-4-yl-4-oxobut-2-enoic acid 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 4-Morpholin-4-yl-4-oxobut-2-enoic acid?
The CAS number of 4-Morpholin-4-yl-4-oxobut-2-enoic acid is 52736-33-1.
What is the molecular formula of 4-Morpholin-4-yl-4-oxobut-2-enoic acid?
The molecular formula of 4-Morpholin-4-yl-4-oxobut-2-enoic acid is C8H11NO4.
What is the molecular weight of 4-Morpholin-4-yl-4-oxobut-2-enoic acid?
The molecular weight of 4-Morpholin-4-yl-4-oxobut-2-enoic acid is 185.07 g/mol.
Where can I buy 4-Morpholin-4-yl-4-oxobut-2-enoic acid?
You can request a quote for 4-Morpholin-4-yl-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-Morpholin-4-yl-4-oxobut-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Morpholin-4-yl-4-oxobut-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.