Niacin aluminum
TL;DR: Niacin aluminum (CAS 1976-28-9) is a chemical compound with molecular formula C18H12AlN3O6 and molecular weight 393.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
aluminum tris(pyridine-3-carboxylate)
Also Known As: Aluminum nicotinate, aluminium nicotinate, NIACIN ALUMINUM, Aluminium trinicotinate, Tris(nicotinato)aluminum
| Molecular Formula | C18H12AlN3O6 |
|---|---|
| Molecular Weight | 393.05 g/mol |
| LogP | -2.05 |
| Topological Polar Surface Area | 159.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 393.05414 |
| Heavy Atoms | 28 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 1976-28-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)[O-].C1=CC(=CN=C1)C(=O)[O-].C1=CC(=CN=C1)C(=O)[O-].[Al+3] |
| InChIKey | NSFYKDVWNTWJOK-UHFFFAOYSA-K |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Niacin aluminum (CAS 1976-28-9), with molecular formula C18H12AlN3O6 and molecular weight 393.05 g/mol. IUPAC: aluminum tris(pyridine-3-carboxylate).
Chemical Property Profile of Niacin aluminum
Property Insights of Niacin aluminum
The XLogP value of -2.05 indicates that Niacin aluminum is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 159.0 Ų indicates high polarity, suggesting Niacin aluminum may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Niacin aluminum has 0 hydrogen bond donor(s) and 9 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 Niacin aluminum?
The CAS number of Niacin aluminum is 1976-28-9.
What is the molecular formula of Niacin aluminum?
The molecular formula of Niacin aluminum is C18H12AlN3O6.
What is the molecular weight of Niacin aluminum?
The molecular weight of Niacin aluminum is 393.05 g/mol.
Where can I buy Niacin aluminum?
You can request a quote for Niacin aluminum directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Niacin aluminum?
Yes, KEHONG BIO provides custom synthesis services for Niacin aluminum and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.