529036

3-ヨードベンゾニトリル

98%

• 化学式: IC₆H₄CN
• CAS番号: 69113-59-3
• 分子量: 229.02
• MDL番号: MFCD00079762
• UNSPSCコード: 12352100
• PubChem Substance ID: 24877638
• NACRES: NA.22

特性

• 品質水準: 100
• アッセイ: 98%
• mp: 40-43 °C (lit.)
• 官能基: iodo; nitrile
• SMILES記法: Ic1cccc(c1)C#N
• InChI: 1S/C7H4IN/c8-7-3-1-2-6(4-7)5-9/h1-4H
• InChI Key: BGARPMGQRREXLN-UHFFFAOYSA-N

詳細

詳細

3-Iodobenzonitrile is a halogenated aromatic nitrile. Its standard (ρ° = 0.1MPa) molar enthalpy of formation was determined by combustion calorimetry.

アプリケーション

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

安全性情報

• 保管分類コード: 11 - Combustible Solids
• WGK: WGK 3
• 引火点(°F): 230.0 °F - closed cup
• 引火点(℃): 110 °C - closed cup
• 個人用保護具 (PPE): Eyeshields, Gloves, type N95 (US)