TL;DR: 2-(2-Nitrophenyl)thiophene-3-carbaldehyde (CAS 129224-60-8) is a chemical compound with molecular formula C11H7NO3S and molecular weight 233.01466 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-nitrophenyl)thiophene-3-carbaldehyde
Also Known As: 2-(2-nitrophenyl)thiophene-3-carbaldehyde, 2-{2-nitrophenyl}-3-thiophenecarbaldehyde, 2-(2-nitrophenyl)-3-thiophenecarboxaldehyde, AI-942/13331435
| Molecular Formula | C11H7NO3S |
| Molecular Weight | 233.01466 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 91.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.01466 Da |
| Heavy Atoms | 16 |
| Complexity | 279.0 |
| SMILES | C1=CC=C(C(=C1)C2=C(C=CS2)C=O)[N+](=O)[O-] |
| InChIKey | TUJKPYKOYHDHMY-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Nitrophenyl)thiophene-3-carbaldehyde. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Nitrophenyl)thiophene-3-carbaldehyde. Following Lipinski's Rule of Five, 2-(2-Nitrophenyl)thiophene-3-carbaldehyde has 0 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 2-(2-Nitrophenyl)thiophene-3-carbaldehyde is 129224-60-8.
The molecular formula of 2-(2-Nitrophenyl)thiophene-3-carbaldehyde is C11H7NO3S.
The molecular weight of 2-(2-Nitrophenyl)thiophene-3-carbaldehyde is 233.01466 g/mol.
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