2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)-
TL;DR: 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)- (CAS 86867-11-0) is a chemical compound with molecular formula C13H13NO5 and molecular weight 263.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[4-(ethoxycarbonylamino)phenyl]-4-oxobut-2-enoic acid
Also Known As: (E)-4-(4-Carbethoxyaminophenyl)-4-oxobuten-2-oic acid, (E)-4-(4-((Ethoxycarbonyl)amino)phenyl)-4-oxo-2-butenoic acid, 2-Butenoicacid,4-(4-( -4-oxo-, -, 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)-, (E)-4-[4-(ethoxycarbonylamino)phenyl]-4-oxobut-2-enoic acid
| Molecular Formula | C13H13NO5 |
|---|---|
| Molecular Weight | 263.08 g/mol |
| LogP | 2.0785 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 263.07938 |
| Heavy Atoms | 19 |
| Complexity | 504.2698 |
Chemical Identifiers
| CAS Number | 86867-11-0 |
|---|---|
| SMILES | CCOC(=O)NC1=CC=C(C=C1)C(=O)/C=C/C(=O)O |
Product Overview
2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)- (CAS 86867-11-0), with molecular formula C13H13NO5 and molecular weight 263.08 g/mol. IUPAC: (E)-4-[4-(ethoxycarbonylamino)phenyl]-4-oxobut-2-enoic acid.
Chemical Property Profile of 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)-
Property Insights of 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)-
The XLogP value of 2.0785 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)-. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)-. Following Lipinski's Rule of Five, 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)- 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 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)-?
The CAS number of 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)- is 86867-11-0.
What is the molecular formula of 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)-?
The molecular formula of 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)- is C13H13NO5.
What is the molecular weight of 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)-?
The molecular weight of 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)- is 263.08 g/mol.
Where can I buy 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)-?
You can request a quote for 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenoic acid, 4-(4-((ethoxycarbonyl)amino)phenyl)-4-oxo-, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.