5-Cyanoindole
5-Cyanoindole Basic information
- Product Name:
- 5-Cyanoindole
- Synonyms:
-
- TIMTEC-BB SBB004148
- INDOLE-5-CARBONITRILE
- 5-INDOLECARBONITRILE
- 5-CI
- 5-CYANOINDOLE
- 5-Cyano-1H-indole
- indoline-5-carbonitrile
- Indolecarbonitrile
- CAS:
- 15861-24-2
- MF:
- C9H6N2
- MW:
- 142.16
- EINECS:
- 239-986-4
- Product Categories:
-
- Building Blocks
- C7 to C9
- Chemical Synthesis
- Heterocyclic Building Blocks
- Heterocycle-Indole series
- Indoles and derivatives
- Simple Indoles
- Indole
- Heterocycles
- Inhibitors
- Pyrroles & Indoles
- Building Blocks
- Heterocyclic Building Blocks
- Pyrroles & Indoles
- Indoles
- Heterocyclic Compounds
- blocks
- Carboxes
- IndolesOxindoles
- Mol File:
- 15861-24-2.mol
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.
- 0-6°C
- pka
- 15.62±0.30(Predicted)
- form
- Crystalline Powder
- color
- White to slightly yellow
- Water Solubility
- Soluble in chloroform, hexane and methanol. Insoluble in water.
- Sensitive
- Air & Light Sensitive
- BRN
- 116738
- InChIKey
- YHYLDEVWYOFIJK-UHFFFAOYSA-N
- 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
- F
- 8-10
- Hazard Note
- Irritant
- HazardClass
- 6.1
- PackingGroup
- III
- HS Code
- 29339990
MSDS
- Language:English Provider:1H-Indole-5-carbonitrile
- Language:English Provider:SigmaAldrich
- Language:English Provider:ACROS
- Language:English Provider:ALFA
5-Cyanoindole Usage And Synthesis
Chemical Properties
Off-White Crystalline Powder
Uses
• ;Reactant for parallel synthesis of dihydroisoquinolines via silver and L-proline co-catalyzed three-component coupling reaction1• ;Reactant for chemoselective and regioselective preparation of benzoyl indoles2• ;Reactant for preparation of novel PPARα/γ dual agonists for potential treatment of metabolic syndrome and IDDM3• ;Reactant for preparation of 4,5-dihydrocyclopenta[c]quinolines by palladium-catalyzed ring-expansion reaction alkynes, using O2 as the oxidant4• ;Reactant for preparation of vinylindoles by hydroarylation of alkynes using indium bromi
Uses
Inhibitor of enzyme.
Purification Methods
Dissolve the nitrile in 95% EtOH, boil it in the presence of charcoal, filter, evaporate to a small volume and add enough H2O to cause crystallisation and cool. Recrystallise it directly from aqueous EtOH and dry it in a vacuum. UV has at max 276 nm (log 3.6) in MeOH. [Lindwall & Mantell J Org Chem 18 345 1953, 20 1458 1955, Thesing at al. Chem Ber 95 2205 1962, NMR: Lallemend & Bernath Bull Soc Chim Fr 4091 1970, Beilstein 22/3 V 45.]
5-Cyanoindole Preparation Products And Raw materials
Raw materials
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5-Cyanoindole(15861-24-2)Related Product Information
- 5-CYANO-2,3-DIHYDRO-1H-INDOLE
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- 5-CYANOGRAMINE
- 5-Cyanoindole-1-acetic acid
- 2-TERT-BUTYL-3-FORMYL-1H-INDOLE-5-CARBONITRILE
- 5-CYANOTRYPTAMINE HYDROCHLORIDE
- Ethyl 5-cyanoindole-2-carboxylate
- 3-(2-AMINO-ETHYL)-2-METHYL-1H-INDOLE-5-CARBONITRILE
- 1-Boc-5-Cyanoindole-2-boronic acid
- 1H-INDOLE-5-CARBONITRILE, 2-PHENYL-
- 5-Cyanoindole
- Indole-3-acetic acid
- 2-Methylindole
- Indometacin
- Methylene dithiocyanate
- Carbonitrile