Fluacrypyrim

Base Information

• Chemical Name: Fluacrypyrim
• CAS No.: 229977-93-9
• Molecular Formula: C20H21F3N2O5
• Molecular Weight: 426.3863
• European Community (EC) Number: 607-186-8
• UNII: FHJ1L9VJTH
• DSSTox Substance ID: DTXSID4058027
• Nikkaji Number: J1.801.482C
• Wikidata: Q22807579
• Metabolomics Workbench ID: 55926
• ChEMBL ID: CHEMBL2392676
• Mol file: 229977-93-9.mol

Synonyms:fluacrypyrim

Chemical Property of Fluacrypyrim

Chemical Property:

• Boiling Point: 529.9±60.0 °C(Predicted)
• PKA: -2.07±0.32(Predicted)
• PSA: 79.77000
• Density: 1.258
• LogP: 4.02190
• Storage Temp.: 0-6°C
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 9
• Exact Mass: 426.14025626
• Heavy Atom Count: 30
• Complexity: 585

Purity/Quality:

98%Min ^*data from raw suppliers

FLUACRYPYRIM 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): N
• Hazard Codes: N
• Statements: 50/53
• Safety Statements: 60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OC1=NC(=CC(=N1)OCC2=CC=CC=C2C(=COC)C(=O)OC)C(F)(F)F
• Isomeric SMILES: CC(C)OC1=NC(=CC(=N1)OCC2=CC=CC=C2/C(=C\OC)/C(=O)OC)C(F)(F)F