TL;DR: 2-Propenoic acid, 1,1'-(2-butene-1,4-diyl) ester (CAS 18621-76-6) is a chemical compound with molecular formula C10H12O4 and molecular weight 196.07356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-prop-2-enoyloxybut-2-enyl prop-2-enoate
Also Known As: 2-Butenediol 1,4-diacrylate, But-2-enylene bisacrylate, But-2-ene-1,4-diyl diacrylate, Acrylic acid, 2-butenylene ester, 4-prop-2-enoyloxybut-2-enyl prop-2-enoate
| Molecular Formula | C10H12O4 |
| Molecular Weight | 196.07356 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 196.07356 Da |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
| SMILES | C=CC(=O)OCC=CCOC(=O)C=C |
| InChIKey | ZJWKFUBDXPALAF-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 1,1'-(2-butene-1,4-diyl) ester. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Propenoic acid, 1,1'-(2-butene-1,4-diyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid, 1,1'-(2-butene-1,4-diyl) ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Propenoic acid, 1,1'-(2-butene-1,4-diyl) ester is 18621-76-6.
The molecular formula of 2-Propenoic acid, 1,1'-(2-butene-1,4-diyl) ester is C10H12O4.
The molecular weight of 2-Propenoic acid, 1,1'-(2-butene-1,4-diyl) ester is 196.07356 g/mol.
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