Ioxynil and triasulfuron
TL;DR: Ioxynil and triasulfuron (CAS 113336-33-7) is a chemical compound with molecular formula C21H19ClI2N6O6S and molecular weight 771.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(2-chloroethoxy)phenyl]sulfonyl-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea;4-hydroxy-3,5-diiodobenzonitrile
Also Known As: Ioxynil and triasulfuron, Triasulfuron and ioxynil, Triasulfuron mixture with ioxynil, 1-[2-(2-chloroethoxy)phenyl]sulfonyl-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea; 4-hydroxy-3,5-diiodobenzonitrile, 2-(2-Chloroethoxy)-N-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]benzene-1-sulfonamide--4-hydroxy-3,5-diiodobenzonitrile (1/1)
| Molecular Formula | C21H19ClI2N6O6S |
|---|---|
| Molecular Weight | 771.89 g/mol |
| LogP | 3.7897 |
| Topological Polar Surface Area | 185.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 771.8865 |
| Heavy Atoms | 37 |
| Complexity | 737.0 |
Chemical Identifiers
| CAS Number | 113336-33-7 |
|---|---|
| SMILES | CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl.C1=C(C=C(C(=C1I)O)I)C#N |
| InChIKey | HOFNMIVIYRTRBO-UHFFFAOYSA-N |
Product Overview
Ioxynil and triasulfuron (CAS 113336-33-7), with molecular formula C21H19ClI2N6O6S and molecular weight 771.89 g/mol. IUPAC: 1-[2-(2-chloroethoxy)phenyl]sulfonyl-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea;4-hydroxy-3,5-diiodobenzonitrile.
Chemical Property Profile of Ioxynil and triasulfuron
Property Insights of Ioxynil and triasulfuron
The XLogP value of 3.7897 indicates that Ioxynil and triasulfuron is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 185.0 Ų indicates high polarity, suggesting Ioxynil and triasulfuron may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ioxynil and triasulfuron has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ioxynil and triasulfuron?
The CAS number of Ioxynil and triasulfuron is 113336-33-7.
What is the molecular formula of Ioxynil and triasulfuron?
The molecular formula of Ioxynil and triasulfuron is C21H19ClI2N6O6S.
What is the molecular weight of Ioxynil and triasulfuron?
The molecular weight of Ioxynil and triasulfuron is 771.89 g/mol.
Where can I buy Ioxynil and triasulfuron?
You can request a quote for Ioxynil and triasulfuron directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ioxynil and triasulfuron?
Yes, KEHONG BIO provides custom synthesis services for Ioxynil and triasulfuron and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.