(4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid
TL;DR: (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid (CAS 746540-24-9) is a chemical compound with molecular formula C8H9AsN2O9 and molecular weight 351.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-nitro-4-(2-nitrooxyethoxy)phenyl]arsonic acid
Also Known As: [3-nitro-4-(2-nitrooxyethoxy)phenyl]arsonic acid, (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid, NCI60_002731, Arsonic acid, (4-(2-(nitrooxy)ethoxy)-3-nitrophenyl)-,, {3-Nitro-4-[2-(nitrooxy)ethoxy]phenyl}arsonic acid
| Molecular Formula | C8H9AsN2O9 |
|---|---|
| Molecular Weight | 351.95 g/mol |
| LogP | -1.2571 |
| Topological Polar Surface Area | 168.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.9524 |
| Heavy Atoms | 20 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 746540-24-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1[As](=O)(O)O)[N+](=O)[O-])OCCO[N+](=O)[O-] |
| InChIKey | DKOFTRQOUMOWGK-UHFFFAOYSA-N |
Product Overview
(4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid (CAS 746540-24-9), with molecular formula C8H9AsN2O9 and molecular weight 351.95 g/mol. IUPAC: [3-nitro-4-(2-nitrooxyethoxy)phenyl]arsonic acid.
Chemical Property Profile of (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid
Property Insights of (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid
The XLogP value of -1.2571 indicates that (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 168.0 Ų indicates high polarity, suggesting (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid has 2 hydrogen bond donor(s) and 9 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 (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid?
The CAS number of (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid is 746540-24-9.
What is the molecular formula of (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid?
The molecular formula of (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid is C8H9AsN2O9.
What is the molecular weight of (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid?
The molecular weight of (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid is 351.95 g/mol.
Where can I buy (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid?
You can request a quote for (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid?
Yes, KEHONG BIO provides custom synthesis services for (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.