4,6-Dinitro-2-methylresorcinol
TL;DR: 4,6-Dinitro-2-methylresorcinol (CAS 124501-36-6) is a chemical compound with molecular formula C7H6N2O6 and molecular weight 214.02258 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-4,6-dinitrobenzene-1,3-diol
Also Known As: 4,6-Dinitro-2-methylresorcinol, 2-methyl-4,6-dinitrobenzene-1,3-diol, 2-methyl-4,6-dinitro-benzene-1,3-diol, 2-methyl-4,6-dinitro-1,3-benzenediol, 661-753-4
Technical Specifications
| Molecular Formula | C7H6N2O6 |
| Molecular Weight | 214.02258 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 132.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 214.02258 Da |
| Heavy Atoms | 15 |
| Complexity | 246.0 |
| SMILES | CC1=C(C(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-])O |
| InChIKey | ODDGTMVJLFKOLT-UHFFFAOYSA-N |
Chemical Property Profile of 4,6-Dinitro-2-methylresorcinol
Property Insights of 4,6-Dinitro-2-methylresorcinol
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Dinitro-2-methylresorcinol. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Dinitro-2-methylresorcinol. Following Lipinski's Rule of Five, 4,6-Dinitro-2-methylresorcinol has 2 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 4,6-Dinitro-2-methylresorcinol?
The CAS number of 4,6-Dinitro-2-methylresorcinol is 124501-36-6.
What is the molecular formula of 4,6-Dinitro-2-methylresorcinol?
The molecular formula of 4,6-Dinitro-2-methylresorcinol is C7H6N2O6.
What is the molecular weight of 4,6-Dinitro-2-methylresorcinol?
The molecular weight of 4,6-Dinitro-2-methylresorcinol is 214.02258 g/mol.
Where can I buy 4,6-Dinitro-2-methylresorcinol?
You can request a quote for 4,6-Dinitro-2-methylresorcinol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,6-Dinitro-2-methylresorcinol?
Yes, CoreyChem provides custom synthesis services for 4,6-Dinitro-2-methylresorcinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.