478334

4-甲基-2-异氰酸硝基苯

95%

• 線性公式: CH₃C₆H₃(NO₂)NCO
• CAS號碼: 57910-98-2
• 分子量：: 178.14
• MDL號碼: MFCD00014705
• 分類程式碼代碼: 12352100
• PubChem物質ID: 24871493

屬性

• 化驗: 95%
• mp: 57-61 °C (lit.)
• 儲存溫度: 2-8°C
• SMILES 字串: Cc1ccc(N=C=O)c(c1)[N+]([O-])=O
• InChI: 1S/C8H6N2O3/c1-6-2-3-7(9-5-11)8(4-6)10(12)13/h2-4H,1H3
• InChI 密鑰: RTXDHIPQKZLDJD-UHFFFAOYSA-N

描述

一般說明

4-Methyl-2-nitrophenyl isocyanate, also known as 1-isocyanato-4-methyl-2-nitrobenzene, is an organic building block containing an isocyanate group. The conformational analysis of 4-methyl-2-nitrophenyl isocyanate has been reported based on its vibrational spectral data and density functional theory (DFT) calculations.

應用

4-Methyl-2-nitrophenyl isocyanate may be used in the preparation 4-methylphenyl analog of 2-[(2-nitrophenyl)amino]furanone.

安全資訊

• 象形圖: GHS08,GHS07
• 訊號詞: Danger
• 危險聲明: H302 + H312 + H332,H315,H317,H319,H334,H335
• 防範說明: P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P305 + P351 + P338
• 危險分類: Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
• 標靶器官: Respiratory system
• 儲存類別代碼: 11 - Combustible Solids
• 水污染物質分類（WGK）: WGK 3
• 閃點（°F）: 235.4 °F - closed cup
• 閃點（°C）: 113 °C - closed cup
• 個人防護裝備: dust mask type N95 (US), Eyeshields, Gloves