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Indole-3-carbonitrile, 98%
CAS: 5457-28-3 | C9H6N2 | 142.16 g/mol
$80.49 - $268.33
Chemical Identifiers
| CAS | 5457-28-3 |
|---|---|
| Molecular Formula | C9H6N2 |
| Molecular Weight (g/mol) | 142.16 |
| MDL Number | MFCD00022717 |
| InChI Key | CHIFTAQVXHNVRW-UHFFFAOYSA-N |
| Synonym | 3-cyanoindole, indole-3-carbonitrile, 3-indolecarbonitrile, chembl46724, zlchem 360, 3-cyano-1h-indole, pubchem7325, acmc-209lhi, 1h-indol-3-yl cyanide |
| PubChem CID | 230282 |
| IUPAC Name | 1H-indole-3-carbonitrile |
| SMILES | N#CC1=CNC2=CC=CC=C12 |
| Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
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| Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
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AAA1604103
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Thermo Scientific Chemicals
A1604103 |
1 g |
Each for $80.49
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AAA1604106
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Thermo Scientific Chemicals
A1604106 |
5 g |
Each for $268.33
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Description
Indole-3-carbonitrile is used as a synthesis reagent for preparation of 4-substituted β-lactams, biologically active indoles, inhibitors of glycogen synthase kinase 3β (GSK-3), indole fragments as inosine monophosphate dehydrogenase (IMPDH) inhibitors and HIV-1 integrase inhibitors. It is also used as a reactant for intramolecular oxidative C-H coupling reactions with applications in medium-ring synthesis techniques and for preparation of tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators.
This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.
ApplicationsIndole-3-carbonitrile is used as a synthesis reagent for preparation of 4-substituted β-lactams, biologically active indoles, inhibitors of glycogen synthase kinase 3β (GSK-3), indole fragments as inosine monophosphate dehydrogenase (IMPDH) inhibitors and HIV-1 integrase inhibitors. It is also used as a reactant for intramolecular oxidative C-H coupling reactions with applications in medium-ring synthesis techniques and for preparation of tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators.
Solubility
Insoluble in water.
Notes
Keep container tightly sealed. Store in cool, dry conditions in well sealed containers. Incompatible with oxidizing agents. It is sensitive to light.
Chemical Identifiers
| 5457-28-3 | |
| 142.16 | |
| CHIFTAQVXHNVRW-UHFFFAOYSA-N | |
| 230282 | |
| N#CC1=CNC2=CC=CC=C12 |
| C9H6N2 | |
| MFCD00022717 | |
| 3-cyanoindole, indole-3-carbonitrile, 3-indolecarbonitrile, chembl46724, zlchem 360, 3-cyano-1h-indole, pubchem7325, acmc-209lhi, 1h-indol-3-yl cyanide | |
| 1H-indole-3-carbonitrile |
Specifications
| 5457-28-3 | |
| Odorless | |
| MFCD00022717 | |
| 120888 | |
| 3-cyanoindole, indole-3-carbonitrile, 3-indolecarbonitrile, chembl46724, zlchem 360, 3-cyano-1h-indole, pubchem7325, acmc-209lhi, 1h-indol-3-yl cyanide | |
| CHIFTAQVXHNVRW-UHFFFAOYSA-N | |
| 1H-indole-3-carbonitrile | |
| 230282 | |
| 98% |
| 177°C to 182°C | |
| C9H6N2 | |
| 1 g | |
| Light sensitive | |
| Insoluble in water. | |
| N#CC1=CNC2=CC=CC=C12 | |
| 142.16 | |
| 142.16 | |
| Indole-3-carbonitrile |
Safety and Handling
GHS H Statement
H302-H315-H319-H335
Harmful if swallowed.
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.
P261-P264b-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P312-P330-P332+P313-P362-P501c
H302+H312+H332-H315-H319-H335
DOTInformation : Hazard Class: 6.1; Packaging Group: III
EINECSNumber : 000-000-0
TSCA : No
Recommended Storage : Ambient temperatures
RUO – Research Use Only