4-Hydroxy-3,5-dinitrobenzaldehyde
TL;DR: 4-Hydroxy-3,5-dinitrobenzaldehyde (CAS 52132-61-3) is a chemical compound with molecular formula C7H4N2O6 and molecular weight 212.00694 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-hydroxy-3,5-dinitrobenzaldehyde
Also Known As: 4-Hydroxy-3,5-dinitrobenzaldehyde, 3,5-Dinitro-4-hydroxybenzaldehyde, Benzaldehyde, 4-hydroxy-3,5-dinitro-, 4-hydroxy-3,5-dinitro-benzaldehyde, Benzaldehyde,4-hydroxy-3,5-dinitro
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H4N2O6 |
| Molecular Weight | 212.00694 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.00694 Da |
| Heavy Atoms | 15 |
| Complexity | 258.0 |
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])C=O |
| InChIKey | DFAVWLKOYKKDFX-UHFFFAOYSA-N |
Chemical Property Profile of 4-Hydroxy-3,5-dinitrobenzaldehyde
Property Insights of 4-Hydroxy-3,5-dinitrobenzaldehyde
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-3,5-dinitrobenzaldehyde. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxy-3,5-dinitrobenzaldehyde. Following Lipinski's Rule of Five, 4-Hydroxy-3,5-dinitrobenzaldehyde has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Hydroxy-3,5-dinitrobenzaldehyde?
The CAS number of 4-Hydroxy-3,5-dinitrobenzaldehyde is 52132-61-3.
What is the molecular formula of 4-Hydroxy-3,5-dinitrobenzaldehyde?
The molecular formula of 4-Hydroxy-3,5-dinitrobenzaldehyde is C7H4N2O6.
What is the molecular weight of 4-Hydroxy-3,5-dinitrobenzaldehyde?
The molecular weight of 4-Hydroxy-3,5-dinitrobenzaldehyde is 212.00694 g/mol.
Where can I buy 4-Hydroxy-3,5-dinitrobenzaldehyde?
You can request a quote for 4-Hydroxy-3,5-dinitrobenzaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Hydroxy-3,5-dinitrobenzaldehyde?
Yes, CoreyChem provides custom synthesis services for 4-Hydroxy-3,5-dinitrobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.