2-Nitrobenzaldehyde semicarbazone
TL;DR: 2-Nitrobenzaldehyde semicarbazone (CAS 16604-43-6) is a chemical compound with molecular formula C8H8N4O3 and molecular weight 208.05965 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(E)-(2-nitrophenyl)methylideneamino]urea
Also Known As: 2-Nitrobenzaldehyde semicarbazone, 2-NP-SCA, 2NP-SEM, 2-(2-Nitrobenzylidene)hydrazinecarboxamide, [(E)-(2-nitrophenyl)methylideneamino]urea
Technical Specifications
| Molecular Formula | C8H8N4O3 |
| Molecular Weight | 208.05965 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.05965 Da |
| Heavy Atoms | 15 |
| Complexity | 274.0 |
| SMILES | C1=CC=C(C(=C1)/C=N/NC(=O)N)[N+](=O)[O-] |
| InChIKey | OEOKLBSECDAYSM-BJMVGYQFSA-N |
Chemical Property Profile of 2-Nitrobenzaldehyde semicarbazone
Property Insights of 2-Nitrobenzaldehyde semicarbazone
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitrobenzaldehyde semicarbazone. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitrobenzaldehyde semicarbazone. Following Lipinski's Rule of Five, 2-Nitrobenzaldehyde semicarbazone has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Nitrobenzaldehyde semicarbazone?
The CAS number of 2-Nitrobenzaldehyde semicarbazone is 16604-43-6.
What is the molecular formula of 2-Nitrobenzaldehyde semicarbazone?
The molecular formula of 2-Nitrobenzaldehyde semicarbazone is C8H8N4O3.
What is the molecular weight of 2-Nitrobenzaldehyde semicarbazone?
The molecular weight of 2-Nitrobenzaldehyde semicarbazone is 208.05965 g/mol.
Where can I buy 2-Nitrobenzaldehyde semicarbazone?
You can request a quote for 2-Nitrobenzaldehyde semicarbazone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Nitrobenzaldehyde semicarbazone?
Yes, CoreyChem provides custom synthesis services for 2-Nitrobenzaldehyde semicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.