Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester
TL;DR: Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester (CAS 100836-58-6) is a chemical compound with molecular formula C7H10N4O4 and molecular weight 214.0702 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl N-(1-methyl-5-nitroimidazol-2-yl)carbamate
Also Known As: ethyl N-(1-methyl-5-nitroimidazol-2-yl)carbamate, (1-Methyl-5-nitro-2-imidazolyl)carbamic acid ethyl ester, CARBAMIC ACID, (1-METHYL-5-NITRO-2-IMIDAZOLYL)-, ETHYL ESTER, ethyl(1-methyl-5-nitro-1h-imidazol-2-yl)carbamate, (1-Methyl-5-nitro-2-imidazolyl)carbamicacidethylester
Technical Specifications
| Molecular Formula | C7H10N4O4 |
| Molecular Weight | 214.0702 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 214.0702 Da |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
| SMILES | CCOC(=O)NC1=NC=C(N1C)[N+](=O)[O-] |
| InChIKey | VILMBXAKVNWOSJ-UHFFFAOYSA-N |
Chemical Property Profile of Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester
Property Insights of Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester. Following Lipinski's Rule of Five, Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester has 1 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 Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester?
The CAS number of Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester is 100836-58-6.
What is the molecular formula of Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester?
The molecular formula of Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester is C7H10N4O4.
What is the molecular weight of Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester?
The molecular weight of Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester is 214.0702 g/mol.
Where can I buy Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester?
You can request a quote for Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for Carbamic acid, (1-methyl-5-nitro-2-imidazolyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.