![2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile structure](/static/products/2831/28317-60-4.webp)
2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile
TL;DR: 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile (CAS 28317-60-4) is a chemical compound with molecular formula C10H8ClN3O and molecular weight 221.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloroanilino)-2-oxopropanimidoyl cyanide
Also Known As: N-(3-chloroanilino)-2-oxopropanimidoyl cyanide, 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile, 2-[(3-chlorophenyl)hydrazinylidene]-3-oxo-butanenitrile, 3-OXO-2-[(3-CHLOROPHENYL)HYDRAZONO]BUTANENITRILE
| Molecular Formula | C10H8ClN3O |
|---|---|
| Molecular Weight | 221.04 g/mol |
| LogP | 2.22048 |
| Topological Polar Surface Area | 65.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.03558 |
| Heavy Atoms | 15 |
| Complexity | 448.2259 |
Chemical Identifiers
| CAS Number | 28317-60-4 |
|---|---|
| SMILES | CC(=O)C(=NNC1=CC(=CC=C1)Cl)C#N |
Product Overview
2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile (CAS 28317-60-4), with molecular formula C10H8ClN3O and molecular weight 221.04 g/mol. IUPAC: N-(3-chloroanilino)-2-oxopropanimidoyl cyanide.
Chemical Property Profile of 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile
Property Insights of 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile
The XLogP value of 2.22048 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile. The TPSA of 65.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile. Following Lipinski's Rule of Five, 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile 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-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile?
The CAS number of 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile is 28317-60-4.
What is the molecular formula of 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile?
The molecular formula of 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile is C10H8ClN3O.
What is the molecular weight of 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile?
The molecular weight of 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile is 221.04 g/mol.
Where can I buy 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile?
You can request a quote for 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(3-Chlorophenyl)hydrazinylidene]-3-oxobutanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.