methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate
TL;DR: methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate (CAS 1013-51-0) is a chemical compound with molecular formula C7H9N3O4 and molecular weight 199.05931 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-(2-methyl-5-nitroimidazol-1-yl)acetate
Also Known As: methyl 2-(2-methyl-5-nitroimidazolyl)acetate, methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate, 1-Methoxycarbonylmethyl-2-methyl-5-nitro-imidazol, methyl 2-(2-methyl-5-nitroimidazol-1-yl)acetate, methyl (2-methyl-5-nitro-1H-imidazol-1-yl)acetate
Technical Specifications
| Molecular Formula | C7H9N3O4 |
| Molecular Weight | 199.05931 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 89.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 199.05931 Da |
| Heavy Atoms | 14 |
| Complexity | 240.0 |
| SMILES | CC1=NC=C(N1CC(=O)OC)[N+](=O)[O-] |
| InChIKey | NVGYIYCHYCPAKA-UHFFFAOYSA-N |
Chemical Property Profile of methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate
Property Insights of methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate. Following Lipinski's Rule of Five, methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate 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 methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate?
The CAS number of methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate is 1013-51-0.
What is the molecular formula of methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate?
The molecular formula of methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate is C7H9N3O4.
What is the molecular weight of methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate?
The molecular weight of methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate is 199.05931 g/mol.
Where can I buy methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate?
You can request a quote for methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate?
Yes, CoreyChem provides custom synthesis services for methyl 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.