Acrinathrin

Base Information

• Chemical Name: Acrinathrin
• CAS No.: 101007-06-1
• Molecular Formula: C26H21 F6 N O5
• Molecular Weight: 541.44
• Hs Code.: 29269090
• UNII: QUI1AZ37K6
• DSSTox Substance ID: DTXSID3041584
• Nikkaji Number: J550.692A
• Wikipedia: Acrinathrin
• Wikidata: Q342726
• Metabolomics Workbench ID: 56165
• ChEMBL ID: CHEMBL2287507
• Mol file: 101007-06-1.mol

Synonyms:2,2-dimethyl-3-(3-oxo-3-(2,2,2-trifluoro-1-(trifluoromethyl)ethoxy)-1-propenyl)cyano(3-phenoxyphenyl)cyclopropanecarboxylic acid, methyl ester;acrinathrin;acrinathrin, 1R-(1alpha(S*)),3alpha(Z)-isomer;cyclopropanecarboxylic acid, 2,2-dimethyl-3-((1Z)-3-oxo-3-(2,2,2-trifluoro-1-(trifluoromethyl)ethoxy)-1-propen-1-yl)-, (S)-cyano(3-phenoxyphenyl)methyl ester, (1R,3S)-

Chemical Property of Acrinathrin

Chemical Property:

• Melting Point: 81.5℃
• Boiling Point: 528.2°Cat760mmHg
• Flash Point: 273.2°C
• PSA: 85.62000
• Density: 1.376g/cm³
• LogP: 6.45158
• Storage Temp.: 0-6°C
• XLogP3: 6.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 10
• Exact Mass: 541.13239174
• Heavy Atom Count: 38
• Complexity: 917

Purity/Quality:

98%,99%, ^*data from raw suppliers

Acrinathrin ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Moderately toxic by skin contact. Low toxicity by ingestion.
• Hazard Codes: Xn,N
• Statements: 20-50/53
• Safety Statements: 60-61

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=CC(=O)OC(C(F)(F)F)C(F)(F)F)C
• Isomeric SMILES: CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C
• Uses: Insecticide.