501-00-8

Name 3-Fluorophenylacetonitrile
CAS 501-00-8
EINECS(EC#) 207-918-2
Molecular Formula C8H6FN
MDL Number MFCD00001907
Molecular Weight 135.14
MOL File 501-00-8.mol

Chemical Properties

Appearance clear light yellow to slightly brown liquid
Melting point  21 °C
Boiling point  113-114 °C18 mm Hg(lit.)
density  1.163 g/mL at 25 °C(lit.)
refractive index  n20/D 1.502(lit.)
Fp  >230 °F
storage temp.  Sealed in dry,Room Temperature
form  powder to lump to clear liquid
color  White or Colorles to Yellow to Orange
Specific Gravity 1.163
BRN  1861071
Exposure limits NIOSH: IDLH 25 mg/m3
InChI InChI=1S/C8H6FN/c9-8-3-1-2-7(6-8)4-5-10/h1-3,6H,4H2
InChIKey DEJPYROXSVVWIE-UHFFFAOYSA-N
SMILES C1(CC#N)=CC=CC(F)=C1
CAS DataBase Reference 501-00-8(CAS DataBase Reference)
NIST Chemistry Reference Benzeneacetonitrile, 3-fluoro-(501-00-8)
EPA Substance Registry System 501-00-8(EPA Substance)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)Skull and Crossbones (GHS06)
GHS07,GHS06
Signal word  Warning
Hazard statements  H302-H312-H315-H319-H332-H335-H331
Precautionary statements  P304+P340-P405-P501a-P261-P280-P305+P351+P338
Hazard Codes  Xn,Xi,T
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
RIDADR  3276
WGK Germany  3
Hazard Note  Toxic
TSCA  T
HazardClass  6.1
PackingGroup  III
HS Code  29269090

Hazard Information

Material Safety Data Sheet(MSDS)

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