4-Formamido-4-oxobut-2-enoic acid
TL;DR: 4-Formamido-4-oxobut-2-enoic acid (CAS 61668-50-6) is a chemical compound with molecular formula C5H5NO4 and molecular weight 143.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-formamido-4-oxobut-2-enoic acid
Also Known As: 4-formamido-4-oxobut-2-enoic acid, 2-Butenoic acid, 4-(formylamino)-4-oxo-
| Molecular Formula | C5H5NO4 |
|---|---|
| Molecular Weight | 143.02 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 143.02185 |
| Heavy Atoms | 10 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 61668-50-6 |
|---|---|
| SMILES | C(=CC(=O)O)C(=O)NC=O |
| InChIKey | HSKSAKBZUITULZ-UHFFFAOYSA-N |
Product Overview
4-Formamido-4-oxobut-2-enoic acid (CAS 61668-50-6), with molecular formula C5H5NO4 and molecular weight 143.02 g/mol. IUPAC: 4-formamido-4-oxobut-2-enoic acid.
Chemical Property Profile of 4-Formamido-4-oxobut-2-enoic acid
Property Insights of 4-Formamido-4-oxobut-2-enoic acid
The XLogP value of -0.9 indicates that 4-Formamido-4-oxobut-2-enoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Formamido-4-oxobut-2-enoic acid. Following Lipinski's Rule of Five, 4-Formamido-4-oxobut-2-enoic acid has 2 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-Formamido-4-oxobut-2-enoic acid?
The CAS number of 4-Formamido-4-oxobut-2-enoic acid is 61668-50-6.
What is the molecular formula of 4-Formamido-4-oxobut-2-enoic acid?
The molecular formula of 4-Formamido-4-oxobut-2-enoic acid is C5H5NO4.
What is the molecular weight of 4-Formamido-4-oxobut-2-enoic acid?
The molecular weight of 4-Formamido-4-oxobut-2-enoic acid is 143.02 g/mol.
Where can I buy 4-Formamido-4-oxobut-2-enoic acid?
You can request a quote for 4-Formamido-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-Formamido-4-oxobut-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Formamido-4-oxobut-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.