2,2-Dinitropropyl methacrylate
TL;DR: 2,2-Dinitropropyl methacrylate (CAS 17977-13-8) is a chemical compound with molecular formula C7H10N2O6 and molecular weight 218.05388 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2-dinitropropyl 2-methylprop-2-enoate
Also Known As: 2,2-Dinitropropyl methacrylate, 2,2-dinitropropyl 2-methylprop-2-enoate, Methacrylic acid 2,2-dinitropropyl ester, 2,2-Dinitropropyl 2-methyl-2-propenoate, 2-Propenoic acid, 2-methyl-, 2,2-dinitropropyl ester
Technical Specifications
| Molecular Formula | C7H10N2O6 |
| Molecular Weight | 218.05388 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 218.05388 Da |
| Heavy Atoms | 15 |
| Complexity | 298.0 |
| SMILES | CC(=C)C(=O)OCC(C)([N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | QTIMQTTZBLVHIH-UHFFFAOYSA-N |
Chemical Property Profile of 2,2-Dinitropropyl methacrylate
Property Insights of 2,2-Dinitropropyl methacrylate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dinitropropyl methacrylate. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Dinitropropyl methacrylate. Following Lipinski's Rule of Five, 2,2-Dinitropropyl methacrylate has 0 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 2,2-Dinitropropyl methacrylate?
The CAS number of 2,2-Dinitropropyl methacrylate is 17977-13-8.
What is the molecular formula of 2,2-Dinitropropyl methacrylate?
The molecular formula of 2,2-Dinitropropyl methacrylate is C7H10N2O6.
What is the molecular weight of 2,2-Dinitropropyl methacrylate?
The molecular weight of 2,2-Dinitropropyl methacrylate is 218.05388 g/mol.
Where can I buy 2,2-Dinitropropyl methacrylate?
You can request a quote for 2,2-Dinitropropyl methacrylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2-Dinitropropyl methacrylate?
Yes, CoreyChem provides custom synthesis services for 2,2-Dinitropropyl methacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.