TL;DR: 2,5-Dimethyl-3,4-furandicarboxylic acid (CAS 14597-13-8) is a chemical compound with molecular formula C8H8O5 and molecular weight 184.03717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,5-dimethylfuran-3,4-dicarboxylic acid
Also Known As: 2,5-dimethylfuran-3,4-dicarboxylic Acid, 2,5-Dimethylfuran-3,4-dicarboxylicacid, 2,5-dimethyl-3,4-furandicarboxylic acid, DIMETHYLFURAN-3,4-DICARBOXYLIC ACID, 2,5-Dimethyl-furan-3,4-dicarboxylic acid
| Molecular Formula | C8H8O5 |
| Molecular Weight | 184.03717 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 87.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.03717 Da |
| Heavy Atoms | 13 |
| Complexity | 213.0 |
| SMILES | CC1=C(C(=C(O1)C)C(=O)O)C(=O)O |
| InChIKey | IDYRARBMMCSVMD-UHFFFAOYSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dimethyl-3,4-furandicarboxylic acid. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Dimethyl-3,4-furandicarboxylic acid. Following Lipinski's Rule of Five, 2,5-Dimethyl-3,4-furandicarboxylic acid has 2 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 2,5-Dimethyl-3,4-furandicarboxylic acid is 14597-13-8.
The molecular formula of 2,5-Dimethyl-3,4-furandicarboxylic acid is C8H8O5.
The molecular weight of 2,5-Dimethyl-3,4-furandicarboxylic acid is 184.03717 g/mol.
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