2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide
TL;DR: 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide (CAS 35013-90-2) is a chemical compound with molecular formula C8H8IN3O and molecular weight 288.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile iodide
Also Known As: 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide, Pyridinium,4-[cyano(hydroxyimino)methyl]-1-methyl-, iodide (
| Molecular Formula | C8H8IN3O |
|---|---|
| Molecular Weight | 288.97 g/mol |
| LogP | -2.78302 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.97122 |
| Heavy Atoms | 13 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 35013-90-2 |
|---|---|
| SMILES | C[N+]1=CC=C(C=C1)C(=NO)C#N.[I-] |
| InChIKey | GJLIKEXLHKULBP-UHFFFAOYSA-N |
Product Overview
2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide (CAS 35013-90-2), with molecular formula C8H8IN3O and molecular weight 288.97 g/mol. IUPAC: 2-hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile iodide.
Chemical Property Profile of 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide
Property Insights of 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide
The XLogP value of -2.78302 indicates that 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide. Following Lipinski's Rule of Five, 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide has 1 hydrogen bond donor(s) and 4 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 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide?
The CAS number of 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide is 35013-90-2.
What is the molecular formula of 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide?
The molecular formula of 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide is C8H8IN3O.
What is the molecular weight of 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide?
The molecular weight of 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide is 288.97 g/mol.
Where can I buy 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide?
You can request a quote for 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyimino-2-(1-methylpyridin-1-ium-4-yl)acetonitrile;iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.