5-Cyanoindole

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5-Cyanoindole Basic information

Product Name:
5-Cyanoindole
CAS:
15861-24-2
MF:
C9H6N2
MW:
142.16
EINECS:
239-986-4
Mol File:
15861-24-2.mol
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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)
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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

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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-CyanoindoleSupplierMore

Alfa Aesar Gold
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400-610-6006; 021-67582000
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saleschina@alfa-asia.com
Megchem Co., Ltd. Gold
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+86 (21) 5471-7132
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sales@molecular-green.com
Shanghai GaoLang Chemical Technology Co., Ltd. Gold
Tel:
021-57340939 021-37285478 18117268940 18916191449
Email:
sales@gaolangchemical.com
Shanghai Jinsai Pharmaceutical and Chemical Co., Ltd. Gold
Tel:
021-57362983,13301713911
Email:
parkbe@hotmail.com
J & K SCIENTIFIC LTD.
Tel:
010-82848833- ;010-82848833-
Email:
jkinfo@jkchemical.com;market6@jkchemical.com
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