Ethyl 3-Fluorobenzoate 3-氟苯甲酸乙酯

CAS 451-02-5 MFCD00000336

化学结构图

451-02-5
SMILES: CCOC(=O)C1C=C(F)C=CC=1

化学属性

Mol. FormulaC9H9FO2
Mol. Weight168.16
Boiling Point94-95 °C at 16 mmHg
Density1.136
Refractive index1.4830 to 1.4870
Flash Point82°C(lit.)
TSCAYes
Melting Point82 °C

别名和识别编码

Chemical NameEthyl 3-Fluorobenzoate
CAS Number451-02-5
Alfabeta NameETHYLFLUOROBENZOATE 3-
MDL NumberMFCD00000336
Synonym Ethyl 3-fluorobenzoate {LY} Ethyl 3-fluorobenzoate {} {LY} Ethyl 3-fluorobenzoate {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-fluorobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-fluo
EC Number207-191-1
Beilstein Registry Number2045876
PubChem Substance ID125307815
Chemical Name Translation3-氟苯甲酸乙酯
Reaxys-RN2045876
InChIKeySMMIKBXLEWTSJD-UHFFFAOYSA-N
LabNetwork Molecule IDLN00115888
Canonical SMILESO=C(OCC)C1=CC=CC(F)=C1
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分类

  • {SNA} Aryl Fluorinated Building Blocks, Building Blocks, C8 to C9, C8-C12, Carbonyl Compounds, Chemical Synthesis, Esters, Fluorinated Building Blocks, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks

安全信息

Warnings IRRITANT
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US) Eyeshields, Gloves, half-mask respirator (EU), half-mask respirator (US), multi-purpose combination respirator cartridge (US)
Signal word Warning
GHS Symbol
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H227 Combustible liquid 可燃液体
Hazard Codes F
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 用途一:医药、农药、液晶材料中间体。
  • Hazard Note:Flammable
  • Acros Organics:Ethyl 3-fluorobenzoate, 98%(451-02-5)
  • Sigma Aldrich:451-02-5(sigmaaldrich)
  • 下游产品:3-(1H-吡唑-3-基)苯甲酸
  • MOL 文件:451-02-5.mol
  • Alfa Aesar:3-氟苯甲酸乙酯,98+% Ethyl 3-fluorobenzoate, 98+%(451-02-5)

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Fluorinated Building Blocks 氟化物砌块
  4. Organic Fluorinated Building Blocks - Fluorinated Building Blocks
  5. Other Fluorinated Organic Building Blocks - Organic Fluorinated Building Blocks
  6. Aryl Fluorinated Building Blocks 芳基氟化物
  7. C8-C12 - Aryl Fluorinated Building Blocks
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters - Carbonyl Compounds
  6. C8 to C9 - Esters
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Halogenated 卤化物 (氟氯溴碘)
  5. Fluoro 氟化物

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