529060

3-氯-5-氟苯甲醚

97%

• 线性分子式: ClC₆H₃(F)OCH₃
• CAS号: 202925-08-4
• 分子量: 160.57
• MDL编号: MFCD00070770
• UNSPSC代码: 12352100
• PubChem化学物质编号: 24877641
• NACRES: NA.22

属性

• 方案: 97%
• 折射率: n20/D 1.511 (lit.)
• 沸点: 189 °C (lit.)
• 密度: 1.265 g/mL at 25 °C (lit.)
• SMILES字符串: COc1cc(F)cc(Cl)c1
• InChI: 1S/C7H6ClFO/c1-10-7-3-5(8)2-6(9)4-7/h2-4H,1H3
• InChI key: XPZBNEWAZPZUHF-UHFFFAOYSA-N

说明

一般描述

3-Chloro-5-fluoroanisole is also referred to as 1-chloro-3-fluoro-5-methoxybenzene (IUPAC name). Two rotational isomeric forms, i.e. cis and trans forms of 3-chloro-5-fluoroanisole (1-chloro-3-fluoro-5-methoxybenzene) have been identified by ab initio and density functional theory (DFT) calculations.[1]

安全信息

• 象形图: GHS07
• 警示用语：: Warning
• 危险声明: H315,H319,H335
• 预防措施声明: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• 危险分类: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• 靶器官: Respiratory system
• 储存分类代码: 10 - Combustible liquids
• WGK: WGK 3
• 闪点(°F): 174.9 °F - closed cup
• 闪点(°C): 79.4 °C - closed cup
• 个人防护装备: Eyeshields, Gloves, type ABEK (EN14387) respirator filter