TL;DR: 2,3-Naphthalenedicarboxaldehyde, 5-nitro- (CAS 103836-27-7) is a chemical compound with molecular formula C12H7NO4 and molecular weight 229.0375 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-nitronaphthalene-2,3-dicarbaldehyde
Also Known As: 5-nitronaphthalene-2,3-dicarbaldehyde, 2,3-Naphthalenedicarboxaldehyde, 5-nitro-, 5-nitro-2,3-naphthalenedicarboxaldehyde, 5-NITRO-2,3-NAPHTHALENEDICARBALDEHYDE
| Molecular Formula | C12H7NO4 |
| Molecular Weight | 229.0375 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 80.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.0375 Da |
| Heavy Atoms | 17 |
| Complexity | 325.0 |
| SMILES | C1=CC2=CC(=C(C=C2C(=C1)[N+](=O)[O-])C=O)C=O |
| InChIKey | QPGMESNZJCVKOW-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Naphthalenedicarboxaldehyde, 5-nitro-. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Naphthalenedicarboxaldehyde, 5-nitro-. Following Lipinski's Rule of Five, 2,3-Naphthalenedicarboxaldehyde, 5-nitro- 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 2,3-Naphthalenedicarboxaldehyde, 5-nitro- is 103836-27-7.
The molecular formula of 2,3-Naphthalenedicarboxaldehyde, 5-nitro- is C12H7NO4.
The molecular weight of 2,3-Naphthalenedicarboxaldehyde, 5-nitro- is 229.0375 g/mol.
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