7-CYANOINDOLE
- Product Name
- 7-CYANOINDOLE
- CAS No.
- 96631-87-7
- Chemical Name
- 7-CYANOINDOLE
- Synonyms
- 7-CyanoindoL;7-Cyanoindole;7-carbonitrile;7-Cyano-1H-indole;Ondansetron Impurity 13;1H-Indole-7-carbonitrile;1H-Indole-7-carbonitrile 97%;7-CHOROINDOLE-3-CARBOXALDEHYDE;7-CYANOINDOLE in stock Factory;Hydrogenated（docosanoic acid）Phosphatidylcholine
- CBNumber
- CB2511539
- Molecular Formula
- C9H6N2
- Formula Weight
- 142.16
- MOL File
- 96631-87-7.mol
7-CYANOINDOLE Property
- Melting point:
- 95-96 °C
- Boiling point:
- 350.0±15.0 °C(Predicted)
- Density
- 1.24±0.1 g/cm3(Predicted)
- storage temp.
- 2-8°C(protect from light)
- solubility
- Chloroform (Sparingly), Methanol (Slightly)
- form
- Solid
- pka
- 14.61±0.30(Predicted)
- color
- White to Pale Yellow
- InChI
- InChI=1S/C9H6N2/c10-6-8-3-1-2-7-4-5-11-9(7)8/h1-5,11H
- InChIKey
- NTUHBYLZRBVHRS-UHFFFAOYSA-N
- SMILES
- N1C2=C(C=CC=C2C#N)C=C1
- CAS DataBase Reference
- 96631-87-7(CAS DataBase Reference)
Safety
- Hazard Codes
- Xn
- Risk Statements
- 20/21/22-22
- Safety Statements
- 22-36/37/39
- RIDADR
- 3439
- HazardClass
- IRRITANT
- HS Code
- 2933998090
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P264Wash hands thoroughly after handling.
P264Wash skin thouroughly after handling.
P271Use only outdoors or in a well-ventilated area.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352IF ON SKIN: wash with plenty of soap and water.
P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P312Call a POISON CENTER or doctor/physician if you feel unwell.
P321Specific treatment (see … on this label).
P332+P313IF SKIN irritation occurs: Get medical advice/attention.
P337+P313IF eye irritation persists: Get medical advice/attention.
P362Take off contaminated clothing and wash before reuse.
P403+P233Store in a well-ventilated place. Keep container tightly closed.
P405Store locked up.
P501Dispose of contents/container to..…
N-Bromosuccinimide Price
- Product number
- CDS008484
- Product name
- 7-cyanoindole
- Purity
- Aldrich<SUP>CPR</SUP>
- Packaging
- 100 mg
- Price
- $107
- Updated
- 2025/07/31
- Product number
- C981330
- Product name
- 7-Cyanoindole
- Packaging
- 5g
- Price
- $325
- Updated
- 2021/12/16
- Product number
- 057849
- Product name
- 1H-Indole-7-carbonitrile
- Purity
- 95%
- Packaging
- 500mg
- Price
- $25
- Updated
- 2021/12/16
- Product number
- 057849
- Product name
- 1H-Indole-7-carbonitrile
- Purity
- 95%
- Packaging
- 1g
- Price
- $39
- Updated
- 2021/12/16
- Product number
- J99756
- Product name
- 7-Cyanoindole
- Packaging
- 1g
- Price
- $40
- Updated
- 2021/12/16
7-CYANOINDOLE Chemical Properties,Usage,Production
Uses
1H-Indole-7-carbonitrile is a chemical reagent used in the synthesis of triazole derivatives as anti-fungal agents. A reagent in the preparation of HIV-1 attachment inhibitors.
Synthesis
51417-51-7
557-21-1
96631-87-7
General procedure for the synthesis of 7-cyanoindoles from 7-bromoindoles and zinc cyanide: Pd(PPh3)4 (103 mg, 0.09 mmol) was added to a mixture of 7-bromo-1H-indole (588 mg, 3 mmol) and Zn(CN)2 in degassed DMF (10 mL). The reaction vial was sealed and heated in a microwave reactor at 170 °C for 15 min. After completion of the reaction, the reaction mixture was diluted with EtOAc, washed sequentially with water and brine, and the organic phase was dried with anhydrous sodium sulfate, filtered and concentrated in vacuum. The crude product was purified by column chromatography (eluent: 100% heptane to heptane/EtOAc 9:1) and the pure product was subsequently recrystallized from heptane. Yield: 350 mg (82%). [0321] 1H NMR (400 MHz, CDCl3) δ 8.74 (br s, 1H), 7.86 (d, 1H, J = 8.0 Hz), 7.52 (d, 1H, J = 7.6 Hz), 7.34 (t, 1H, J = 2.6 Hz), 7.17 (t, 1H, J = 8.0 Hz), 6.65 (m, 1H).
References
[1] Patent: WO2007/79239, 2007, A2. Location in patent: Page/Page column 99-100
7-CYANOINDOLE Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 7-CYANOINDOLE manufacturers
- Product
- 7-CYANOINDOLE in stock Factory 96631-87-7
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- TOP 3 Factory in China
- Supply Ability
- Top 3 largest production capacity Factory
- Release date
- 2019-04-03
- Product
- 7-CYANOINDOLE 96631-87-7
- Price
- US $7.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 100kg
- Release date
- 2020-01-02