50712-63-5

Name 2-(4-Nitrophenyl)propiononitrile
CAS 50712-63-5
EINECS(EC#) 256-731-2
Molecular Formula C9H8N2O2
MDL Number MFCD03427171
Molecular Weight 176.17
MOL File 50712-63-5.mol
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Chemical Properties

Melting point  74-78 °C (lit.)
Boiling point  324.1±25.0 °C(Predicted)
density  1.217±0.06 g/cm3(Predicted)
storage temp.  Storage temp. 2-8°C
Appearance Light yellow to yellow Solid
InChI InChI=1S/C9H8N2O2/c1-7(6-10)8-2-4-9(5-3-8)11(12)13/h2-5,7H,1H3
InChIKey QCPKTMACPAKCKW-UHFFFAOYSA-N
SMILES C1(C(C)C#N)C=CC([N+]([O-])=O)=CC=1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P362-P403+P233-P405-P501
Hazard Codes  Xi
Safety Statements 
WGK Germany  3
REACH Registrations Active
HazardClass  IRRITANT
HS Code  2926907090
Storage Class 11 - Combustible Solids

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