Imidazole, sodium derivative
TL;DR: Imidazole, sodium derivative (CAS 5587-42-8) is a chemical compound with molecular formula C3H4N2Na+ and molecular weight 91.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 1H-imidazole
Also Known As: Imidazole, sodium derivative, Sodium imidazolide, sodium 1H-imidazole, 1H-Imidazole, sodium salt, 1h-imidazole, sodium salt(1:1)
| Molecular Formula | C3H4N2Na+ |
|---|---|
| Molecular Weight | 91.03 g/mol |
| LogP | -2.59 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 91.027214 |
| Heavy Atoms | 6 |
| Complexity | 28.0 |
Chemical Identifiers
| CAS Number | 5587-42-8 |
|---|---|
| SMILES | C1=CN=CN1.[Na+] |
| InChIKey | KYPWTIZOPWGPMK-UHFFFAOYSA-N |
Product Overview
Imidazole, sodium derivative (CAS 5587-42-8), with molecular formula C3H4N2Na+ and molecular weight 91.03 g/mol. IUPAC: sodium 1H-imidazole.
Chemical Property Profile of Imidazole, sodium derivative
Property Insights of Imidazole, sodium derivative
The XLogP value of -2.59 indicates that Imidazole, sodium derivative is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 28.7 Ų, Imidazole, sodium derivative exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Imidazole, sodium derivative has 1 hydrogen bond donor(s) and 1 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, sodium derivative?
The CAS number of Imidazole, sodium derivative is 5587-42-8.
What is the molecular formula of Imidazole, sodium derivative?
The molecular formula of Imidazole, sodium derivative is C3H4N2Na+.
What is the molecular weight of Imidazole, sodium derivative?
The molecular weight of Imidazole, sodium derivative is 91.03 g/mol.
Where can I buy Imidazole, sodium derivative?
You can request a quote for Imidazole, sodium derivative directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazole, sodium derivative?
Yes, KEHONG BIO provides custom synthesis services for Imidazole, sodium derivative and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.