40805-50-3

Name Benzonitrile, 4-(chloroacetyl)- (9CI)
CAS 40805-50-3
Molecular Formula C9H6ClNO
MDL Number MFCD13172603
Molecular Weight 179.6
MOL File 40805-50-3.mol
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Chemical Properties

Melting point  98-100 °C
Boiling point  340.1±22.0 °C(Predicted)
density  1.26±0.1 g/cm3(Predicted)
storage temp.  Storage temp. 2-8°C
solubility  Chloroform (Sparingly), Methanol (Slightly)
form  Solid
color  Off-White to Pale Yellow
InChI InChI=1S/C9H6ClNO/c10-5-9(12)8-3-1-7(6-11)2-4-8/h1-4H,5H2
InChIKey LDHNCFIXYHXVDN-UHFFFAOYSA-N
SMILES C(#N)C1=CC=C(C(CCl)=O)C=C1

Safety Data

Symbol(GHS)  Corrosion (GHS05)Exclamation Mark (GHS07)
GHS05,GHS07
Signal word  Danger
Hazard statements  H315-H318-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P310-P332+P313-P362-P403+P233-P405-P501

Hazard Information

Spectrum Detail

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