p-Arsenoso-N-(cyanomethyl)benzamide
TL;DR: p-Arsenoso-N-(cyanomethyl)benzamide (CAS 5425-13-8) is a chemical compound with molecular formula C9H7AsN2O2 and molecular weight 249.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-arsoroso-N-(cyanomethyl)benzamide
Also Known As: NIOSH/CV2343300, p-Arsenoso-N-(cyanomethyl)benzamide, n-(cyanomethyl)-4-(oxoarsanyl)benzamide, 4-arsoryl-N-(cyanomethyl)benzamide, 4-arsoroso-N-(cyanomethyl)benzamide
| Molecular Formula | C9H7AsN2O2 |
|---|---|
| Molecular Weight | 249.97 g/mol |
| LogP | -0.38502 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.97235 |
| Heavy Atoms | 14 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 5425-13-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NCC#N)[As]=O |
| InChIKey | WQYUHYHVVWEEMZ-UHFFFAOYSA-N |
Product Overview
p-Arsenoso-N-(cyanomethyl)benzamide (CAS 5425-13-8), with molecular formula C9H7AsN2O2 and molecular weight 249.97 g/mol. IUPAC: 4-arsoroso-N-(cyanomethyl)benzamide.
Chemical Property Profile of p-Arsenoso-N-(cyanomethyl)benzamide
Property Insights of p-Arsenoso-N-(cyanomethyl)benzamide
The XLogP value of -0.38502 indicates that p-Arsenoso-N-(cyanomethyl)benzamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for p-Arsenoso-N-(cyanomethyl)benzamide. Following Lipinski's Rule of Five, p-Arsenoso-N-(cyanomethyl)benzamide has 1 hydrogen bond donor(s) and 3 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 p-Arsenoso-N-(cyanomethyl)benzamide?
The CAS number of p-Arsenoso-N-(cyanomethyl)benzamide is 5425-13-8.
What is the molecular formula of p-Arsenoso-N-(cyanomethyl)benzamide?
The molecular formula of p-Arsenoso-N-(cyanomethyl)benzamide is C9H7AsN2O2.
What is the molecular weight of p-Arsenoso-N-(cyanomethyl)benzamide?
The molecular weight of p-Arsenoso-N-(cyanomethyl)benzamide is 249.97 g/mol.
Where can I buy p-Arsenoso-N-(cyanomethyl)benzamide?
You can request a quote for p-Arsenoso-N-(cyanomethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Arsenoso-N-(cyanomethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for p-Arsenoso-N-(cyanomethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.