Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)-
TL;DR: Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)- (CAS 36941-60-3) is a chemical compound with molecular formula C6H6ClN3O2 and molecular weight 187.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-1-methyl-2-(2-nitroethenyl)imidazole
Also Known As: Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)-, 5-chloro-1-methyl-2-[(E)-2-nitroethenyl]imidazole
| Molecular Formula | C6H6ClN3O2 |
|---|---|
| Molecular Weight | 187.01 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 187.01485 |
| Heavy Atoms | 12 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 36941-60-3 |
|---|---|
| SMILES | CN1C(=CN=C1C=C[N+](=O)[O-])Cl |
| InChIKey | KEYJSJJHAGICQD-UHFFFAOYSA-N |
Product Overview
Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)- (CAS 36941-60-3), with molecular formula C6H6ClN3O2 and molecular weight 187.01 g/mol. IUPAC: 5-chloro-1-methyl-2-(2-nitroethenyl)imidazole.
Chemical Property Profile of Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)-
Property Insights of Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)-. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)-. Following Lipinski's Rule of Five, Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)- has 0 hydrogen bond donor(s) and 3 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 Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)-?
The CAS number of Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)- is 36941-60-3.
What is the molecular formula of Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)-?
The molecular formula of Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)- is C6H6ClN3O2.
What is the molecular weight of Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)-?
The molecular weight of Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)- is 187.01 g/mol.
Where can I buy Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)-?
You can request a quote for Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)-?
Yes, KEHONG BIO provides custom synthesis services for Imidazole, 5-chloro-1-methyl-2-(2-nitrovinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.