| Identification | More | [Name]
2-Iodobenzonitrile | [CAS]
4387-36-4 | [Synonyms]
1-CYANO-2-IODOBENZENE
2-IODOBENZONITRILE
O-IODOBENZONITRILE
2-iodobenzontirlle | [Molecular Formula]
C7H4IN | [MDL Number]
MFCD00079761 | [Molecular Weight]
229.02 | [MOL File]
4387-36-4.mol |
| Chemical Properties | Back Directory | [Appearance]
Yellow solid | [Melting point ]
52-54°C | [Boiling point ]
147 °C / 15mmHg | [density ]
1.91±0.1 g/cm3(Predicted) | [Fp ]
110 °C | [storage temp. ]
Keep in dark place,Sealed in dry,Room Temperature | [solubility ]
soluble in Methanol | [form ]
Solid | [color ]
Yellow | [InChI]
InChI=1S/C7H4IN/c8-7-4-2-1-3-6(7)5-9/h1-4H | [InChIKey]
JDDAFHUEOVUDFJ-UHFFFAOYSA-N | [SMILES]
C(#N)C1=CC=CC=C1I | [CAS DataBase Reference]
4387-36-4(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi,Xn | [Risk Statements ]
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
R36:Irritating to the eyes.
R22:Harmful if swallowed. | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection . | [RIDADR ]
3439 | [WGK Germany ]
3 | [Hazard Note ]
Harmful | [HazardClass ]
IRRITANT-HARMFUL | [PackingGroup ]
III | [HS Code ]
29269090 |
| Hazard Information | Back Directory | [Chemical Properties]
Yellow solid | [Uses]
suzuki reaction | [Synthesis]
GENERAL STEPS: A THF solution (2 mL) of 2-iodobenzamide (1.0 mmol) and triethoxysilane (0.50 g, 3.0 mmol) was added to a 25 mL Schlenk tube. The reaction mixture was stirred continuously at 60 °C until complete consumption of 2-iodobenzamide was confirmed by thin layer chromatography (TLC) and gas chromatography-mass spectrometry (GC-MS). Upon completion of the reaction, 2-iodocyanobenzene was purified according to the method reported by Beller literature. | [References]
[1] Tetrahedron Letters, 1986, vol. 27, # 20, p. 2203 - 2206
[2] Catalysis Communications, 2019, p. 72 - 75
[3] Catalysis Communications, 2016, vol. 86, p. 148 - 150
[4] Dalton Transactions, 2018, vol. 47, # 12, p. 4352 - 4359
[5] Journal of Organic Chemistry, 1965, vol. 30, p. 617 - 620 |
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