(4-Methyl-3-nitrophenyl)arsonic acid
TL;DR: (4-Methyl-3-nitrophenyl)arsonic acid (CAS 6955-17-5) is a chemical compound with molecular formula C7H8AsNO5 and molecular weight 260.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methyl-3-nitrophenyl)arsonic acid
Also Known As: (4-methyl-3-nitrophenyl)arsonic acid, p-Toluene-3-nitroarsonic acid, 3-Nitro-p-toluenearsonic acid, 4-Methyl-3-nitrobenzenearsonic acid, Arsonic acid, (4-methyl-3-nitrophenyl)-
| Molecular Formula | C7H8AsNO5 |
|---|---|
| Molecular Weight | 260.96 g/mol |
| LogP | -0.53578 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 260.96185 |
| Heavy Atoms | 14 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 6955-17-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[As](=O)(O)O)[N+](=O)[O-] |
| InChIKey | ZZCRGEZBCCUBTK-UHFFFAOYSA-N |
Product Overview
(4-Methyl-3-nitrophenyl)arsonic acid (CAS 6955-17-5), with molecular formula C7H8AsNO5 and molecular weight 260.96 g/mol. IUPAC: (4-methyl-3-nitrophenyl)arsonic acid.
Chemical Property Profile of (4-Methyl-3-nitrophenyl)arsonic acid
Property Insights of (4-Methyl-3-nitrophenyl)arsonic acid
The XLogP value of -0.53578 indicates that (4-Methyl-3-nitrophenyl)arsonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Methyl-3-nitrophenyl)arsonic acid. Following Lipinski's Rule of Five, (4-Methyl-3-nitrophenyl)arsonic acid has 2 hydrogen bond donor(s) and 5 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-Methyl-3-nitrophenyl)arsonic acid?
The CAS number of (4-Methyl-3-nitrophenyl)arsonic acid is 6955-17-5.
What is the molecular formula of (4-Methyl-3-nitrophenyl)arsonic acid?
The molecular formula of (4-Methyl-3-nitrophenyl)arsonic acid is C7H8AsNO5.
What is the molecular weight of (4-Methyl-3-nitrophenyl)arsonic acid?
The molecular weight of (4-Methyl-3-nitrophenyl)arsonic acid is 260.96 g/mol.
Where can I buy (4-Methyl-3-nitrophenyl)arsonic acid?
You can request a quote for (4-Methyl-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-Methyl-3-nitrophenyl)arsonic acid?
Yes, KEHONG BIO provides custom synthesis services for (4-Methyl-3-nitrophenyl)arsonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.