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Substance
ID:328147
Structure
Similarity
Functional Group
Text
ID:59017
3-Cyanoindole
Sigma Aldrich
ID: 347949
Names and Identifiers
IUPAC name
1H-indole-3-carbonitrile
IUPAC Traditional name
3-cyanoindole
Synonyms
3-Indolecarbonitrile
NSC 24935
3-Cyanoindole
3-氰基吲哚
3-吲哚甲腈
Registration numbers
MDL Number
MFCD00022717
CAS Number
5457-28-3
PubChem SID
24861537
Properties
Safety Information
MSDS Link
Download link
GHS Precautionary statements
P261
-
P280
-
P305+P351+P338
German water hazard class
3
GHS Signal Word
Warning
GHS Hazard statements
H302
-
H312
-
H315
-
H319
-
H332
-
H335
Safety Statements
26
-
37/39
GHS Pictograms
Acute toxicity (oral, dermal, inhalation), category 4
Skin irritation, category 2
Eye irritation, category 2
Skin sensitisation, category 1
Specific Target Organ Toxicity – Single exposure, category 3
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
European Hazard Symbols
Harmful (Xn)
Risk Statements
20/21/22
-
36/37/38
Product Information
Purity
98%
Empirical Formula (Hill Notation)
C9H6N2
Physical Property
Melting Point
179-182 °C(lit.)
Molecule Details
Packaging
1, 5 g in glass bottle
Application
Reactant for preparation of:
• Tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators1
• Inhibitors of the C-terminal domain of RNA polymerase II with antitumor activities
• 4-substituted β-lactams2
• Biologically active Indoles3
• Inhibitors of glycogen synthase kinase 3β (GSK-3)4
• HIV-1 integrase inhibitors5
• Indole fragments as inosine monophosphate dehydrogenase (IMPDH) inhibitors6
• Aziridinomitosene skeleton7
• Potential antiviral agents8Reactant for:
• Intramolecular oxidative C-H coupling reactions with applications in medium-ring synthesis techniques9
Molecular Spectra
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References
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