3-Pyridinecarboxylic acid, 2-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-6-(trifluoromethyl)-, methyl ester, sodium salt (1:1)

Base Information

• Chemical Name: 3-Pyridinecarboxylic acid, 2-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-6-(trifluoromethyl)-, methyl ester, sodium salt (1:1)
• CAS No.: 144740-54-5
• Molecular Formula: C15H14 F3 N5 O7 S . Na
• Molecular Weight: 487.348
• European Community (EC) Number: 604-441-5
• Mol file: 144740-54-5.mol

Synonyms:C15-H13-F3-N5-Na-O7-S;3-Pyridinecarboxylic acid, 2-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-6-(trifluoromethyl)-, methyl ester, sodium salt (1:1);methyl 2-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-6-(trifluoromethyl)-3-pyridinecarboxylate monosodium salt;SCHEMBL1535822;CHEBI:82014;XVPAYLVQXRJFBG-UHFFFAOYSA-N;CID 53297412;C18855

Chemical Property of 3-Pyridinecarboxylic acid, 2-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-6-(trifluoromethyl)-, methyl ester, sodium salt (1:1)

Chemical Property:

• Melting Point: 172-173°
• Boiling Point: °Cat760mmHg
• PKA: 4.9(at 25℃)
• Flash Point: °C
• PSA: 158.29000
• Density: g/cm³
• LogP: 2.53510
• Solubility.: Solubility in organic solvents (g/l at 20 °C) Acetone 3.1 (93.4%) Acetonitrile 4.3 Benzene 0.028 Dichloromethane 0.60 Hexane <0.001 Methanol 5.0 n‐Octanol 0.19
• Water Solubility.: Solubility in water (g l?1at 20 °C) 0.06 (93.4%) (pH 5) 0.61 (pH 6) Instability of the solution (pH 7)
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 7
• Exact Mass: 488.04637274
• Heavy Atom Count: 32
• Complexity: 736

Purity/Quality:

98%Min ^*data from raw suppliers

Flupyrsulfuron-methyl sodium PESTANAL ^*data from reagent suppliers

Safty Information:

• Hazard Codes: N
• Statements: 50/53
• Safety Statements: 60-61

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na]
• Uses: Herbicide.