TL;DR: 2-Propenoic acid, 2,3,3-triiodo- (CAS 14092-44-5) is a chemical compound with molecular formula C3HI3O2 and molecular weight 449.7111 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3,3-triiodoprop-2-enoic acid
Also Known As: triiodoacrylic acid, triiodo-acrylic acid, Acrylic acid, triiodo-, 2,3,3-Triiod-acrylsaeure, 2,3,3-triiodoprop-2-enoic Acid
| Molecular Formula | C3HI3O2 |
| Molecular Weight | 449.7111 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 449.7111 Da |
| Heavy Atoms | 8 |
| Complexity | 135.0 |
| SMILES | C(=C(I)I)(C(=O)O)I |
| InChIKey | NZLNBGMVMJKWDS-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 2,3,3-triiodo-. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Propenoic acid, 2,3,3-triiodo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid, 2,3,3-triiodo- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Propenoic acid, 2,3,3-triiodo- is 14092-44-5.
The molecular formula of 2-Propenoic acid, 2,3,3-triiodo- is C3HI3O2.
The molecular weight of 2-Propenoic acid, 2,3,3-triiodo- is 449.7111 g/mol.
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