2,2'-(2-Fluoro-1,3-phenylene)diacetonitrile

Base Information

• Chemical Name: 2,2'-(2-Fluoro-1,3-phenylene)diacetonitrile
• CAS No.: 175136-84-2
• Molecular Formula: C10H7FN2
• Molecular Weight: 174.17
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID00371085
• Wikidata: Q82158328
• Mol file: 175136-84-2.mol

Synonyms:175136-84-2;2,2'-(2-Fluoro-1,3-phenylene)diacetonitrile;1,3-Bis(cyanomethyl)-2-fluorobenzene;2-[3-(cyanomethyl)-2-fluorophenyl]acetonitrile;2-Fluorobenzene-1,3-diacetonitrile;1,3-Benzenediacetonitrile,2-fluoro-;Maybridge1_003226;HMS550K14;DTXSID00371085;MFCD00052861;AKOS006230618;FT-0606571;A811765

Chemical Property of 2,2'-(2-Fluoro-1,3-phenylene)diacetonitrile

Chemical Property:

• Vapor Pressure: 7.6E-05mmHg at 25°C
• Melting Point: 75 °C
• Refractive Index: 1.549
• Boiling Point: 327.5 °C at 760 mmHg
• Flash Point: 151.9 °C
• PSA: 47.58000
• Density: 1.192 g/cm³
• LogP: 1.95786
• Storage Temp.: 2-8°C
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 174.05932639
• Heavy Atom Count: 13
• Complexity: 231

Purity/Quality:

97% ^*data from raw suppliers

2-Fluorobenzene-1,3-diacetonitrile 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 23/24/25
• Safety Statements: 36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1)CC#N)F)CC#N

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