TL;DR: 2,4-D-isopropylammonium (CAS 5742-17-6) is a chemical compound with molecular formula C11H15Cl2NO3 and molecular weight 279.0429 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,4-dichlorophenoxy)acetate;propan-2-ylazanium
Also Known As: Caswell No. 315U, 2,4-D-isopropylammonium, 2,4-D isopropylamine salt, 2,4-D-isopropylammonium [ISO], 2-(2,4-dichlorophenoxy)acetate
| Molecular Formula | C11H15Cl2NO3 |
| Molecular Weight | 279.0429 g/mol |
| XLogP | 0.76 |
| Topological Polar Surface Area (TPSA) | 77.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 279.0429 Da |
| Heavy Atoms | 17 |
| Complexity | 191.0 |
| SMILES | CC(C)[NH3+].C1=CC(=C(C=C1Cl)Cl)OCC(=O)[O-] |
| InChIKey | HXMBBZAHRWCZOX-UHFFFAOYSA-N |
The XLogP value of 0.76 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-D-isopropylammonium. The TPSA of 77.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-D-isopropylammonium. Following Lipinski's Rule of Five, 2,4-D-isopropylammonium has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,4-D-isopropylammonium is 5742-17-6.
The molecular formula of 2,4-D-isopropylammonium is C11H15Cl2NO3.
The molecular weight of 2,4-D-isopropylammonium is 279.0429 g/mol.
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