TL;DR: 2-Propenoic acid, 1,1'-(thiodi-2,1-ethanediyl) ester (CAS 19721-37-0) is a chemical compound with molecular formula C10H14O4S and molecular weight 230.06128 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-prop-2-enoyloxyethylsulfanyl)ethyl prop-2-enoate
Also Known As: Thiodi-2,1-ethanediyl diacrylate, Thiobisethylene bisacrylate, 2-Propenoic acid, thiodi-2,1-ethanediyl ester, Thiol diethylene glycol diacrylate, thiobis(ethane-2,1-diyl) diacrylate
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H14O4S |
| Molecular Weight | 230.06128 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 77.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 230.06128 Da |
| Heavy Atoms | 15 |
| Complexity | 214.0 |
| SMILES | C=CC(=O)OCCSCCOC(=O)C=C |
| InChIKey | MGBCNPZYUKYBIJ-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 1,1'-(thiodi-2,1-ethanediyl) ester. The TPSA of 77.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid, 1,1'-(thiodi-2,1-ethanediyl) ester. Following Lipinski's Rule of Five, 2-Propenoic acid, 1,1'-(thiodi-2,1-ethanediyl) ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Propenoic acid, 1,1'-(thiodi-2,1-ethanediyl) ester is 19721-37-0.
The molecular formula of 2-Propenoic acid, 1,1'-(thiodi-2,1-ethanediyl) ester is C10H14O4S.
The molecular weight of 2-Propenoic acid, 1,1'-(thiodi-2,1-ethanediyl) ester is 230.06128 g/mol.
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