529036
3-Iodobenzonitrile
98%
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About This Item
Formula condensata:
IC6H4CN
Numero CAS:
Peso molecolare:
229.02
Numero MDL:
Codice UNSPSC:
12352100
ID PubChem:
NACRES:
NA.22
Prodotti consigliati
Livello qualitativo
Saggio
98%
Punto di fusione
40-43 °C (lit.)
Gruppo funzionale
iodo
nitrile
Stringa SMILE
Ic1cccc(c1)C#N
InChI
1S/C7H4IN/c8-7-3-1-2-6(4-7)5-9/h1-4H
BGARPMGQRREXLN-UHFFFAOYSA-N
Descrizione generale
3-Iodobenzonitrile is a halogenated aromatic nitrile. Its standard (ρ° = 0.1MPa) molar enthalpy of formation was determined by combustion calorimetry.
Applicazioni
3-Iodobenzonitrile may be used as a starting reagent in the synthesis of tetrachloroisophthalo-[14C]-nitrile (TCIN). It may also be used in the preparation of:
- 1-(3-iodophenyl)-3-{2-[4-(trifluoromethyl)-1-piperidinyl]ethyl}-2-imidazolidinone
- piperidine derivative
- chiral amino acid anilide
Codice della classe di stoccaggio
11 - Combustible Solids
Classe di pericolosità dell'acqua (WGK)
WGK 3
Punto d’infiammabilità (°F)
230.0 °F - closed cup
Punto d’infiammabilità (°C)
110 °C - closed cup
Dispositivi di protezione individuale
Eyeshields, Gloves, type N95 (US)
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Thermodynamic and aromaticity studies for the assessment of the halogen? cyano interactions on Iodobenzonitrile.
Rocha IM, et al.
The Journal of Chemical Thermodynamics, 65, 204-212 (2013)
Synthesis of Chiral Amino Acid Anilides by Ligand-Free Copper-Catalyzed Selective N-Arylation of Amino Acid Amides
Dong J, et al.
Advanced Synthesis & Catalysis, 355(4), 692-696 (2013)
Idriss Bennacef et al.
Bioorganic & medicinal chemistry letters, 19(17), 5056-5059 (2009-07-29)
Compound 1 is a potent and selective antagonist of the dopamine D(3) receptor. With the aim of developing a carbon-11 labeled ligand for the dopamine D(3) receptor, 1 was selected as a potential PET probe. [(11)C]1 was obtained by palladium
Dominic P Affron et al.
European journal of organic chemistry, 2016(1), 139-149 (2016-02-16)
Saturated heterocycles, such as THFs, pyrrolidines, piperidines and THPs, are essential components of many biologically active compounds. Examples of C-H functionalization on these important ring systems remain scarce, especially at unactivated positions. Here we report the development of conditions for
Synthesis of tetrachloroisophthalo-[14C]-nitrile.
Davies PE.
Journal of Labelled Compounds & Radiopharmaceuticals, 21(3), 285-292 (1984)
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