TL;DR: Imidazole, 2-fluoro-5-[2-carboxyvinyl]- (CAS 464924-55-8) is a chemical compound with molecular formula C6H5FN2O2 and molecular weight 156.03351 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(2-fluoro-1H-imidazol-5-yl)prop-2-enoic acid
Also Known As: Imidazole, 2-fluoro-5-[2-carboxyvinyl]-, (alphaE)-2-Fluoro-1H-imidazole-5-propenoic acid, (E)-3-(2-fluoro-1H-imidazol-4-yl)acrylic acid, 2-Propenoic acid, 3-(2-fluoro-1H-imidazol-5-yl)-, (2E)-3-(2-fluoro-1H-imidazol-5-yl)prop-2-enoic acid
| Molecular Formula | C6H5FN2O2 |
| Molecular Weight | 156.03351 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 156.03351 Da |
| Heavy Atoms | 11 |
| Complexity | 183.0 |
| SMILES | C1=C(NC(=N1)F)/C=C/C(=O)O |
| InChIKey | CEXJVOYUMZSGHY-OWOJBTEDSA-N |
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazole, 2-fluoro-5-[2-carboxyvinyl]-. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Imidazole, 2-fluoro-5-[2-carboxyvinyl]-. Following Lipinski's Rule of Five, Imidazole, 2-fluoro-5-[2-carboxyvinyl]- has 2 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 Imidazole, 2-fluoro-5-[2-carboxyvinyl]- is 464924-55-8.
The molecular formula of Imidazole, 2-fluoro-5-[2-carboxyvinyl]- is C6H5FN2O2.
The molecular weight of Imidazole, 2-fluoro-5-[2-carboxyvinyl]- is 156.03351 g/mol.
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