6-Hydroxy-2,4-dimethylnicotinonitrile
TL;DR: 6-Hydroxy-2,4-dimethylnicotinonitrile (CAS 1704-19-4) is a chemical compound with molecular formula C8H8N2O and molecular weight 148.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dimethyl-6-oxo-1H-pyridine-3-carbonitrile
Also Known As: 6-Hydroxy-2,4-dimethylnicotinonitrile, 2,4-dimethyl-6-oxo-1,6-dihydropyridine-3-carbonitrile, 4,6-dimethyl-5-cyano-2-pyridone, 2,4-dimethyl-6-oxo-1H-pyridine-3-carbonitrile, 2-Hydroxy-4,6-dimethyl-5-cyano-pyridin
| Molecular Formula | C8H8N2O |
|---|---|
| Molecular Weight | 148.06 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 148.06366 |
| Heavy Atoms | 11 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 1704-19-4 |
|---|---|
| SMILES | CC1=CC(=O)NC(=C1C#N)C |
| InChIKey | OSLDZOOVQHCMAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Hydroxy-2,4-dimethylnicotinonitrile (CAS 1704-19-4), with molecular formula C8H8N2O and molecular weight 148.06 g/mol. IUPAC: 2,4-dimethyl-6-oxo-1H-pyridine-3-carbonitrile.
Chemical Property Profile of 6-Hydroxy-2,4-dimethylnicotinonitrile
Property Insights of 6-Hydroxy-2,4-dimethylnicotinonitrile
The XLogP value of -0.1 indicates that 6-Hydroxy-2,4-dimethylnicotinonitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.9 Ų, 6-Hydroxy-2,4-dimethylnicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Hydroxy-2,4-dimethylnicotinonitrile has 1 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 6-Hydroxy-2,4-dimethylnicotinonitrile?
The CAS number of 6-Hydroxy-2,4-dimethylnicotinonitrile is 1704-19-4.
What is the molecular formula of 6-Hydroxy-2,4-dimethylnicotinonitrile?
The molecular formula of 6-Hydroxy-2,4-dimethylnicotinonitrile is C8H8N2O.
What is the molecular weight of 6-Hydroxy-2,4-dimethylnicotinonitrile?
The molecular weight of 6-Hydroxy-2,4-dimethylnicotinonitrile is 148.06 g/mol.
Where can I buy 6-Hydroxy-2,4-dimethylnicotinonitrile?
You can request a quote for 6-Hydroxy-2,4-dimethylnicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxy-2,4-dimethylnicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxy-2,4-dimethylnicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.