Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1)
TL;DR: Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1) (CAS 41094-07-9) is a chemical compound with molecular formula C15H19N3O5 and molecular weight 321.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-3-(1-phenylethyl)imidazole-4-carboxylate;nitric acid
Also Known As: DL-1-(alpha-Methylbenzyl)-2-methylimidazole-5-carboxylic acid ethyl ester nitrate, (+-)-2-Methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylic acid ethyl ester mononitrate, ethyl 2-methyl-1-(1-phenylethyl)-1h-imidazole-5-carboxylate nitrate(1:1), 1H-Imidazole-5-carboxylic acid, 2-methyl-1-(1-phenylethyl)-, ethyl ester, mononitrate, (+-)-, ethyl 2-methyl-3-(1-phenylethyl)imidazole-4-carboxylate,nitric acid
| Molecular Formula | C15H19N3O5 |
|---|---|
| Molecular Weight | 321.13 g/mol |
| LogP | 2.62982 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 321.13248 |
| Heavy Atoms | 23 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 41094-07-9 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N1C(C)C2=CC=CC=C2)C.[N+](=O)(O)[O-] |
| InChIKey | OCRZZEHGAYSYSO-UHFFFAOYSA-N |
Product Overview
Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1) (CAS 41094-07-9), with molecular formula C15H19N3O5 and molecular weight 321.13 g/mol. IUPAC: ethyl 2-methyl-3-(1-phenylethyl)imidazole-4-carboxylate;nitric acid.
Chemical Property Profile of Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1)
Property Insights of Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1)
The XLogP value of 2.62982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1). The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1). Following Lipinski's Rule of Five, Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1) has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1)?
The CAS number of Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1) is 41094-07-9.
What is the molecular formula of Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1)?
The molecular formula of Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1) is C15H19N3O5.
What is the molecular weight of Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1)?
The molecular weight of Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1) is 321.13 g/mol.
Where can I buy Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1)?
You can request a quote for Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Nitric acid--ethyl 2-methyl-1-(1-phenylethyl)-1H-imidazole-5-carboxylate (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.