ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate
TL;DR: ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate (CAS 31926-73-5) is a chemical compound with molecular formula C10H14N2O4 and molecular weight 226.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate
Also Known As: ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate, ethyl (E)-3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate
| Molecular Formula | C10H14N2O4 |
|---|---|
| Molecular Weight | 226.10 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 98.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 226.09535 |
| Heavy Atoms | 16 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 31926-73-5 |
|---|---|
| SMILES | CCOC(=O)C(=C(C)N)C1CC(=O)NC1=O |
| InChIKey | QRIKHIZFBIVKFV-UHFFFAOYSA-N |
Product Overview
ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate (CAS 31926-73-5), with molecular formula C10H14N2O4 and molecular weight 226.10 g/mol. IUPAC: ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate.
Chemical Property Profile of ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate
Property Insights of ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate
The XLogP value of -0.3 indicates that ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate. Following Lipinski's Rule of Five, ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate 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 ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate?
The CAS number of ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate is 31926-73-5.
What is the molecular formula of ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate?
The molecular formula of ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate is C10H14N2O4.
What is the molecular weight of ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate?
The molecular weight of ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate is 226.10 g/mol.
Where can I buy ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate?
You can request a quote for ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-amino-2-(2,5-dioxopyrrolidin-3-yl)but-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.