![(E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid structure](/static/products/1131/1131006-80-8.webp)
(E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid
TL;DR: (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid (CAS 1131006-80-8) is a chemical compound with molecular formula C14H18N2O3 and molecular weight 262.13174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid
Also Known As: BAS 00511921, J2.609.083K, 3-(4-Diethylamino-phenylcarbamoyl)-acrylic acid, (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid, 3-{[4-(diethylamino)phenyl]carbamoyl}prop-2-enoic acid
Technical Specifications
| Molecular Formula | C14H18N2O3 |
| Molecular Weight | 262.13174 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 262.13174 Da |
| Heavy Atoms | 19 |
| Complexity | 330.0 |
| SMILES | CCN(CC)C1=CC=C(C=C1)NC(=O)/C=C/C(=O)O |
| InChIKey | YUMYXNLWGRTNRB-MDZDMXLPSA-N |
Chemical Property Profile of (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid
Property Insights of (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid. Following Lipinski's Rule of Five, (E)-4-[4-(diethylamino)anilino]-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
What is the CAS number of (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid?
The CAS number of (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid is 1131006-80-8.
What is the molecular formula of (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid?
The molecular formula of (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid is C14H18N2O3.
What is the molecular weight of (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid?
The molecular weight of (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid is 262.13174 g/mol.
Where can I buy (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid?
You can request a quote for (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid?
Yes, CoreyChem provides custom synthesis services for (E)-4-[4-(diethylamino)anilino]-4-oxobut-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.