TL;DR: 3-Fluoro-4-(2-oxopyrrolidin-1-yl)benzaldehyde (CAS 1023515-51-6) is a chemical compound with molecular formula C11H10FNO2 and molecular weight 207.06955 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-fluoro-4-(2-oxopyrrolidin-1-yl)benzaldehyde
Also Known As: 3-fluoro-4-(2-oxopyrrolidin-1-yl)benzaldehyde
| Molecular Formula | C11H10FNO2 |
| Molecular Weight | 207.06955 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.06955 Da |
| Heavy Atoms | 15 |
| Complexity | 269.0 |
| SMILES | C1CC(=O)N(C1)C2=C(C=C(C=C2)C=O)F |
| InChIKey | AVUFAAVLFNROTN-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Fluoro-4-(2-oxopyrrolidin-1-yl)benzaldehyde. With a topological polar surface area (TPSA) of 37.4 Ų, 3-Fluoro-4-(2-oxopyrrolidin-1-yl)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Fluoro-4-(2-oxopyrrolidin-1-yl)benzaldehyde has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Fluoro-4-(2-oxopyrrolidin-1-yl)benzaldehyde is 1023515-51-6.
The molecular formula of 3-Fluoro-4-(2-oxopyrrolidin-1-yl)benzaldehyde is C11H10FNO2.
The molecular weight of 3-Fluoro-4-(2-oxopyrrolidin-1-yl)benzaldehyde is 207.06955 g/mol.
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