1H-Imidazolium, 1,3-dimethyl-4-nitro-
TL;DR: 1H-Imidazolium, 1,3-dimethyl-4-nitro- (CAS 59866-18-1) is a chemical compound with molecular formula C5H8N3O2+ and molecular weight 142.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-4-nitroimidazol-1-ium
Also Known As: 1,3-Dimethyl-4-nitroimidazolium, 1,3-Dimethyl-4-nitro-1H-imidazolium, 1H-IMIDAZOLIUM, 1,3-DIMETHYL-4-NITRO-, 1,3-dimethyl-4-nitroimidazol-1-ium, 1,3-dimethyl-4-nitro-1H-imidazol-3-ium
| Molecular Formula | C5H8N3O2+ |
|---|---|
| Molecular Weight | 142.06 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 142.06165 |
| Heavy Atoms | 10 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 59866-18-1 |
|---|---|
| SMILES | CN1C=[N+](C=C1[N+](=O)[O-])C |
| InChIKey | CRPRBFHOCLDMMB-UHFFFAOYSA-N |
Product Overview
1H-Imidazolium, 1,3-dimethyl-4-nitro- (CAS 59866-18-1), with molecular formula C5H8N3O2+ and molecular weight 142.06 g/mol. IUPAC: 1,3-dimethyl-4-nitroimidazol-1-ium.
Chemical Property Profile of 1H-Imidazolium, 1,3-dimethyl-4-nitro-
Property Insights of 1H-Imidazolium, 1,3-dimethyl-4-nitro-
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazolium, 1,3-dimethyl-4-nitro-. With a topological polar surface area (TPSA) of 54.6 Ų, 1H-Imidazolium, 1,3-dimethyl-4-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Imidazolium, 1,3-dimethyl-4-nitro- has 0 hydrogen bond donor(s) and 2 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 1H-Imidazolium, 1,3-dimethyl-4-nitro-?
The CAS number of 1H-Imidazolium, 1,3-dimethyl-4-nitro- is 59866-18-1.
What is the molecular formula of 1H-Imidazolium, 1,3-dimethyl-4-nitro-?
The molecular formula of 1H-Imidazolium, 1,3-dimethyl-4-nitro- is C5H8N3O2+.
What is the molecular weight of 1H-Imidazolium, 1,3-dimethyl-4-nitro-?
The molecular weight of 1H-Imidazolium, 1,3-dimethyl-4-nitro- is 142.06 g/mol.
Where can I buy 1H-Imidazolium, 1,3-dimethyl-4-nitro-?
You can request a quote for 1H-Imidazolium, 1,3-dimethyl-4-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Imidazolium, 1,3-dimethyl-4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazolium, 1,3-dimethyl-4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.