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Pentafluorobenzonitrile Structure

Pentafluorobenzonitrile

Chemical Properties

Melting point 2.4 °C
Boiling point 162-164 °C(lit.)
Density  1.532 g/mL at 25 °C(lit.)
refractive index  n20/D 1.442(lit.)
Flash point 85 °F
storage temp.  Sealed in dry,2-8°C
form  clear liquid
color  Colorless to Almost colorless
BRN  1913453
Exposure limits NIOSH: IDLH 25 mg/m3
InChI InChI=1S/C7F5N/c8-3-2(1-13)4(9)6(11)7(12)5(3)10
InChIKey YXWJGZQOGXGSSC-UHFFFAOYSA-N
SMILES C(#N)C1=C(F)C(F)=C(F)C(F)=C1F
CAS DataBase Reference 773-82-0(CAS DataBase Reference)
FDA UNII 68CN7ME67X
NIST Chemistry Reference Benzonitrile, pentafluoro-(773-82-0)
EPA Substance Registry System Pentafluorobenzonitrile (773-82-0)

Safety

Symbol(GHS)
Signal wordWarning
Hazard statements H302-H312-H315-H319-H331-H335-H226
Precautionary statements P210-P261-P303+P361+P353-P305+P351+P338-P405-P501a
Hazard Codes  Xi,F,T
Risk Statements  10
Safety Statements  16
RIDADR  UN 1993 3/PG 3
WGK Germany  3
Hazard Note  Irritant/Flammable
TSCA  T
HazardClass  3
PackingGroup  III
HS Code  29269095
NFPA 704:
3
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