3,5-Dinitrobenzaldehyde
TL;DR: 3,5-Dinitrobenzaldehyde (CAS 14193-18-1) is a chemical compound with molecular formula C7H4N2O5 and molecular weight 196.01202 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-dinitrobenzaldehyde
Also Known As: 3,5-dinitrobenzaldehyde, Benzaldehyde, 3,5-dinitro-, Benzaldehyde,3,5-dinitro, Benzaldehyde,3,5-dinitro-, 3.5-Dinitro-benzaldehyd
Technical Specifications
| Molecular Formula | C7H4N2O5 |
| Molecular Weight | 196.01202 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.01202 Da |
| Heavy Atoms | 14 |
| Complexity | 234.0 |
| SMILES | C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C=O |
| InChIKey | YCTNWTBGSOCMRO-UHFFFAOYSA-N |
Chemical Property Profile of 3,5-Dinitrobenzaldehyde
Property Insights of 3,5-Dinitrobenzaldehyde
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dinitrobenzaldehyde. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dinitrobenzaldehyde. Following Lipinski's Rule of Five, 3,5-Dinitrobenzaldehyde has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,5-Dinitrobenzaldehyde?
The CAS number of 3,5-Dinitrobenzaldehyde is 14193-18-1.
What is the molecular formula of 3,5-Dinitrobenzaldehyde?
The molecular formula of 3,5-Dinitrobenzaldehyde is C7H4N2O5.
What is the molecular weight of 3,5-Dinitrobenzaldehyde?
The molecular weight of 3,5-Dinitrobenzaldehyde is 196.01202 g/mol.
Where can I buy 3,5-Dinitrobenzaldehyde?
You can request a quote for 3,5-Dinitrobenzaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,5-Dinitrobenzaldehyde?
Yes, CoreyChem provides custom synthesis services for 3,5-Dinitrobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.