TL;DR: 4-[2-[2-(3-Carboxyprop-2-enoyloxy)ethoxy]ethoxy]-4-oxobut-2-enoic acid (CAS 62538-61-8) is a chemical compound with molecular formula C12H14O9 and molecular weight 302.06378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[2-[2-(3-carboxyprop-2-enoyloxy)ethoxy]ethoxy]-4-oxobut-2-enoic acid
Also Known As: Diethylene glycol bis(maleate), 2-Butenedioic acid (Z)-, oxydi-2,1-ethanediyl ester, 2-Butenedioic acid (2Z)-, oxydi-2,1-ethanediyl ester, 2-Butenedioic acid (2Z)-, 1,1'-(oxydi-2,1-ethanediyl) ester
| Molecular Formula | C12H14O9 |
| Molecular Weight | 302.06378 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 136.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 302.06378 Da |
| Heavy Atoms | 21 |
| Complexity | 396.0 |
| SMILES | C(COC(=O)C=CC(=O)O)OCCOC(=O)C=CC(=O)O |
| InChIKey | UFEKWYVZBKRJRV-UHFFFAOYSA-N |
The XLogP value of -0.6 indicates that 4-[2-[2-(3-Carboxyprop-2-enoyloxy)ethoxy]ethoxy]-4-oxobut-2-enoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2-[2-(3-Carboxyprop-2-enoyloxy)ethoxy]ethoxy]-4-oxobut-2-enoic acid. Following Lipinski's Rule of Five, 4-[2-[2-(3-Carboxyprop-2-enoyloxy)ethoxy]ethoxy]-4-oxobut-2-enoic acid has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[2-[2-(3-Carboxyprop-2-enoyloxy)ethoxy]ethoxy]-4-oxobut-2-enoic acid is 62538-61-8.
The molecular formula of 4-[2-[2-(3-Carboxyprop-2-enoyloxy)ethoxy]ethoxy]-4-oxobut-2-enoic acid is C12H14O9.
The molecular weight of 4-[2-[2-(3-Carboxyprop-2-enoyloxy)ethoxy]ethoxy]-4-oxobut-2-enoic acid is 302.06378 g/mol.
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