Basic information Safety Supplier Related

3-Cyanoindole

Basic information Safety Supplier Related

3-Cyanoindole Basic information

Product Name:
3-Cyanoindole
Synonyms:
  • 3-CYANOINDOLE
  • 3-INDOLECARBONITRILE
  • 1H-INDOLE-3-CARBONITRILE
  • RARECHEM AH BS 0093
  • INDOLE-3-CARBONITRILE
  • indoline-3-carbonitrile
  • Indole-3-carbonitrile,98%
  • 3-Indonylnitrile
CAS:
5457-28-3
MF:
C9H6N2
MW:
142.16
EINECS:
212-232-1
Product Categories:
  • Pyrroles & Indoles
  • Pyrroles & Indoles
  • Pharmaceutical Raw Materials
  • blocks
  • Indole
  • Indoles
  • Carboxes
  • IndolesOxindoles
  • Indoles and derivatives
  • IndoleDerivative
  • bc0001
Mol File:
5457-28-3.mol
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3-Cyanoindole Chemical Properties

Melting point:
179-182 °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,Sealed in dry,Room Temperature
solubility 
Chloroform (Slightly), Methanol (Slightly)
form 
Solid
pka
14.61±0.30(Predicted)
color 
Orange to Brown
Water Solubility 
Insoluble in water.
Sensitive 
Air & Light Sensitive
BRN 
120888
CAS DataBase Reference
5457-28-3(CAS DataBase Reference)
NIST Chemistry Reference
3-Indolecarbonitrile(5457-28-3)
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Safety Information

Hazard Codes 
Xn
Risk Statements 
20/21/22-36/37/38
Safety Statements 
26-37/39-36/37/39
RIDADR 
3439
WGK Germany 
3
HazardClass 
6.1
PackingGroup 
III
HS Code 
29339900

MSDS

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3-Cyanoindole Usage And Synthesis

Chemical Properties

brown-grey to brown crystalline powder

Uses

3-Cyanoindole (cas# 5457-28-3) is a compound useful in organic synthesis.

Uses

Reactant for preparation of:

  • Tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators
  • Inhibitors of the C-terminal domain of RNA polymerase II with antitumor activities
  • 4-substituted β-lactams
  • Biologically active Indoles
  • Inhibitors of glycogen synthase kinase 3β (GSK-3)
  • HIV-1 integrase inhibitors
  • Indole fragments as inosine monophosphate dehydrogenase (IMPDH) inhibitors
  • Aziridinomitosene skeleton
  • Potential antiviral agents

Reactant for:
  • Intramolecular oxidative C-H coupling reactions with applications in medium-ring synthesis techniques

Synthesis Reference(s)

Organic Syntheses, Coll. Vol. 5, p. 656, 1973
Tetrahedron, 50, p. 6549, 1994 DOI: 10.1016/S0040-4020(01)89685-X
Tetrahedron Letters, 18, p. 4417, 1977 DOI: 10.1016/S0040-4039(01)83524-3

General Description

3-Cyanoindole undergoes regiospecific bromination to afford 6-bromo-3-cyanoindole. 3-Cyanoindole is formed during the flash vacuum thermolysis (FVT) of 3-azidoquinoline.

3-Cyanoindole Preparation Products And Raw materials

Raw materials

3-CyanoindoleSupplier

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