3-CYANOINDOLE

Synonyms. 3-Cyanoindole; 1H-Indole-3-carbonitrile; Indole-3-carbonitrile; 3-Indolecarbonitrile; 1H-indole-3-kohlenitrile;

3-CYANOINDOLE

Click for original image

 

PRODUCT IDENTIFICATION

CAS RN

5457-28-3

EINECS RN

201

FORMULA

 C9H6N2

MOLE WEIGHT

142016

H.S CODE

 2933.99.7900

SMILES

 C1=CC=C2C(=C1)C(=CN2)C#N

CLASSIFICATION

 

EXTRA NOTES

 

 

PHYSICAL AND CHEMICAL PROPERTIES

PHYSICAL STATE

off-white to yellow powder

MELTING POINT

179 ~ 182 C

BOILING POINT

 

DENSITY

 

SOLUBILITY IN WATER

 

SOLVENT SOLUBILITY

 

VAPOR DENSITY

 

log P(octanol-water)

  

VAPOR PRESSURE

  

AUTOIGNITION TEMP

  
pK

 

REFRACTIVE INDEX

 

FLASH POINT

 

 

STABILITY AND REACTIVITY
STABILITY Stable under normal conditions.

INCOMPATIBLE MATERIALS

Strong oxidizing agents.

POLYMERIZATION

Has not been reported

NFPA RATINGS

Health: 2, Flammability: 1, Reactivity: 0

 

EXTERNAL LINKS & GENERAL DESCRIPTION

USA.gov - 3-Cyanoindole

Google Scholar Search - 3-Cyanoindole

U.S. National Library of Medicine - 3-Cyanoindole

PubChem Compound Summary - 3-Cyanoindole

NCBI (http://www.ncbi.nlm.nih.gov/) -  3-Cyanoindole

http://www.sigmaaldrich.com/
Application
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

 

SALES SPECIFICATION

APPEARANCE

off-white to yellow powder

ASSAY

98.0% min

MELTING POINT

179 ~ 182 C

ASH

0.2% max

LOSS ON DRYING

0.5% max

HEAVY METALS

10ppm max

 

TRANSPORT & REGULATORY INFORMATION

UN NO.

 

HAZARD CLASS

 

PACKING GROUP  

 

SAFETY INFORMATION

HAZARD OVERVIEW

GHS (Globally Harmonised System) Classification: Acute toxicity (Inhalation, Dermal, Oral). Skin irritation. Eye irritation. Specific target organ toxicity - single exposure. Hazard statements: Harmful if swallowed or in contact with skin. Causes skin irritation. Causes serious eye irritation. Harmful if inhaled. May cause respiratory irritation.

SIGNAL WORD Warning

PICTOGRAMS

PICTOGRAM_GHS07_exclamation.jpg

HAZARD STATEMENTS

H302 + H312-H312-H315-H319-H332-H335

P STATEMENTS

P261-P280-P305 + P351 + P338

EC DIRECTIVES

 

HAZARD CODES

CODE_Xn_Xi_harmful_Irritant.gif

RISK PHRASES

20/21/22-36/37/38

SAFETY PHRASES

26-37/39

 

PACKING

Preserved in light-resistant and well-closed bottles

 

PRICE INFORMATION