2-Hydroxyimino-2-pyridin-4-ylacetonitrile
TL;DR: 2-Hydroxyimino-2-pyridin-4-ylacetonitrile (CAS 4185-97-1) is a chemical compound with molecular formula C7H5N3O and molecular weight 147.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyimino-2-pyridin-4-ylacetonitrile
Also Known As: 2-nitroso-2-(pyridin-4(1H)-ylidene)acetonitrile
| Molecular Formula | C7H5N3O |
|---|---|
| Molecular Weight | 147.04 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 69.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 147.04326 |
| Heavy Atoms | 11 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 4185-97-1 |
|---|---|
| SMILES | C1=CN=CC=C1C(=NO)C#N |
| InChIKey | UIIWSJXQDJBESC-UHFFFAOYSA-N |
Product Overview
2-Hydroxyimino-2-pyridin-4-ylacetonitrile (CAS 4185-97-1), with molecular formula C7H5N3O and molecular weight 147.04 g/mol. IUPAC: 2-hydroxyimino-2-pyridin-4-ylacetonitrile.
Chemical Property Profile of 2-Hydroxyimino-2-pyridin-4-ylacetonitrile
Property Insights of 2-Hydroxyimino-2-pyridin-4-ylacetonitrile
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxyimino-2-pyridin-4-ylacetonitrile. The TPSA of 69.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxyimino-2-pyridin-4-ylacetonitrile. Following Lipinski's Rule of Five, 2-Hydroxyimino-2-pyridin-4-ylacetonitrile 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-pyridin-4-ylacetonitrile?
The CAS number of 2-Hydroxyimino-2-pyridin-4-ylacetonitrile is 4185-97-1.
What is the molecular formula of 2-Hydroxyimino-2-pyridin-4-ylacetonitrile?
The molecular formula of 2-Hydroxyimino-2-pyridin-4-ylacetonitrile is C7H5N3O.
What is the molecular weight of 2-Hydroxyimino-2-pyridin-4-ylacetonitrile?
The molecular weight of 2-Hydroxyimino-2-pyridin-4-ylacetonitrile is 147.04 g/mol.
Where can I buy 2-Hydroxyimino-2-pyridin-4-ylacetonitrile?
You can request a quote for 2-Hydroxyimino-2-pyridin-4-ylacetonitrile 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-pyridin-4-ylacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyimino-2-pyridin-4-ylacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.