4-Nitrobenzylidene malononitrile
TL;DR: 4-Nitrobenzylidene malononitrile (CAS 2700-23-4) is a chemical compound with molecular formula C10H5N3O2 and molecular weight 199.03818 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-nitrophenyl)methylidene]propanedinitrile
Also Known As: 2-(4-Nitrobenzylidene)malononitrile, 4-Nitrobenzylidenemalononitrile, Dicyano-p-nitrostyrene, 2-[(4-nitrophenyl)methylidene]propanedinitrile, 2-[(4-nitrophenyl)methylene]malononitrile
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H5N3O2 |
| Molecular Weight | 199.03818 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 93.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 199.03818 Da |
| Heavy Atoms | 15 |
| Complexity | 350.0 |
| SMILES | C1=CC(=CC=C1C=C(C#N)C#N)[N+](=O)[O-] |
| InChIKey | BDTIGNGBIBFXSE-UHFFFAOYSA-N |
Product Description
Applications: 4-Nitrobenzylidene malononitrile is used in imaging, photographic, and photosensitive formulations, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
4-Nitrobenzylidene malononitrile is a photographic chemical identified by CAS number 2700-23-4 and the molecular formula C10H5N3O2 and a molecular weight of 199.04 g/mol. Synonyms include 2-(4-Nitrobenzylidene)malononitrile and 4-Nitrobenzylidenemalononitrile.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-Nitrobenzylidene malononitrile
Property Insights of 4-Nitrobenzylidene malononitrile
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitrobenzylidene malononitrile. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrobenzylidene malononitrile. Following Lipinski's Rule of Five, 4-Nitrobenzylidene malononitrile has 0 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 4-Nitrobenzylidene malononitrile?
The CAS number of 4-Nitrobenzylidene malononitrile is 2700-23-4.
What is the molecular formula of 4-Nitrobenzylidene malononitrile?
The molecular formula of 4-Nitrobenzylidene malononitrile is C10H5N3O2.
What is the molecular weight of 4-Nitrobenzylidene malononitrile?
The molecular weight of 4-Nitrobenzylidene malononitrile is 199.03818 g/mol.
What are the applications of 4-Nitrobenzylidene malononitrile?
4-Nitrobenzylidene malononitrile is used in imaging, photographic, and photosensitive formulations, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy 4-Nitrobenzylidene malononitrile?
You can request a quote for 4-Nitrobenzylidene malononitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Nitrobenzylidene malononitrile?
Yes, CoreyChem provides custom synthesis services for 4-Nitrobenzylidene malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.