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5-Cyanoindole Structure

5-Cyanoindole

Chemical Properties

Melting point 106-108 °C(lit.)
Boiling point 249.72°C (rough estimate)
Density  1.1777 (rough estimate)
refractive index  1.6211 (estimate)
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  Chloroform, Hexane, Methanol
form  Crystalline Powder
pka 15.62±0.30(Predicted)
color  White to slightly yellow
Water Solubility  Soluble in chloroform, hexane and methanol. Insoluble in water.
Sensitive  Air & Light Sensitive
BRN  116738
InChI InChI=1S/C9H6N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,11H
InChIKey YHYLDEVWYOFIJK-UHFFFAOYSA-N
SMILES N1C2=C(C=C(C#N)C=C2)C=C1
CAS DataBase Reference 15861-24-2(CAS DataBase Reference)

Safety Information

Hazard Codes  Xi,Xn
Risk Statements  36/37/38-20/21/22
Safety Statements  26-36-22
RIDADR  3276
WGK Germany  3
RTECS  NL5993120
8-10
Hazard Note  Irritant
HazardClass  6.1
PackingGroup  III
HS Code  29339990

MSDS

Usage And Synthesis

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