3-(Trifluoromethyl)Benzoic Acid Methyl Ester 3-三氟甲基苯甲酸甲酯

CAS 2557-13-3 MFCD00043543

化学结构图

2557-13-3
SMILES: COC(=O)c1cccc(C(F)(F)F)c1

化学属性

Mol. FormulaC9H7F3O2
Mol. Weight204.15
Boiling Point208.6°C at 760 mmHg
Density1.295
Refractive index1.4490 to 1.4530
Flash Point40°C
TSCANo
Appearance 无色透明液体,沸点 93-95 ;°C20 ;mm Hg ,密度 1.295 ;g/mL ;at 25 ;°C ,折光率 n 20/D 1.453 ,闪点 105 ;°F

别名和识别编码

Chemical Name3-(Trifluoromethyl)Benzoic Acid Methyl Ester
CAS Number2557-13-3
Alfabeta NameMETHYLTRIFLUOROMETHYLBENZOATE 3()-
MDL NumberMFCD00043543
Synonym Methyl 3-(trifluoromethyl)benzoate {LY} Methyl 3-(trifluoromethyl)benzoate {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {} {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {} {} {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {} {} {} {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {} {} {} {} {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-(trifluoromethyl)benzoate {} {} {} {} {} {}
Beilstein Registry Number1963428
PubChem Substance ID520213
EC Number250-023-7
Reaxys-RN1963428
Chemical Name Translation3-三氟甲基苯甲酸甲酯
LabNetwork Molecule IDLN00114009
InChIInChI=1S/C9H7F3O2/c1-14-8(13)6-3-2-4-7(5-6)9(10,11)12/h2-5H,1H3
Canonical SMILESC1=C(C=CC=C1C(=O)OC)C(F)(F)F
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ester; 1fragment
  • {SNA} Building Blocks, C8 to C9, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks

相关文献及参考

  • Short: III/35D2
  • Short: III/35E
  • Beilstein:9(4)1710

安全信息

Warnings IRRITANT
WGK Germany3
Risk Statements
  • R10 Flammable 易燃
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后,立即用大量水冲洗并征求医生意见;
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护;
  • S16 Keep away from sources of ignition - No smoking 远离火源,禁止吸烟;
GHS Symbol
Hazard statements
  • H226 Flammable liquid and vapour 易燃液体和蒸气
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
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。
  • P233 Keep container tightly closed. ?保持容器密闭。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P241 Use explosion-proof electrical/ventilating/lighting/…/equipment. 使用防爆电气/通风/照明/ .../设备。
  • P242 Use only non-sparking tools. 只能使用无火花工具。
  • P243 Take precautionary measures against static discharge. 采取预防措施,防止静电放电。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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。
  • P302+P352
  • P303+P361+P353
  • P304+P340
  • P305+P351+P338
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适,呼叫解毒中心或医生/医师。
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • P332+P313
  • P337+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服,清洗后方可重新使用
  • P370+P378
  • P403+P233
  • P403+P235
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word
Hazard Codes
UN Number
Packing GroupIII
Hazard Class3
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

  • Hazard Note:Flammable/Irritant
  • 3-三氟甲基苯甲酸甲酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M1718 3-(三氟甲基)苯甲酸甲酯 Methyl 3-(Trifluoromethyl)benzoate 5G 344元 2014/06/02 M1718 3-(三氟甲基)苯甲酸甲酯 Methyl 3-(Trifluoromethyl)benzoate 25G 1050元 2010/06/21 319860050 3-三氟甲基苯甲酸甲酯 Methyl 3-(trifluoromethyl)benzoate 99% 5 ML 450元
  • Acros Organics:3-(三氟甲基)苯甲酸甲酯 Methyl 3-(trifluoromethyl)benzoate, 99%(2557-13-3)
  • MSDS 信息:3-(Trifluoromethyl)benzoic acid methyl ester(2557-13-3).msds
  • MOL 文件:2557-13-3.mol
  • Sigma Aldrich:2557-13-3(sigmaaldrich)
  • TCI Shanghai:3-三氟甲基苯甲酸甲酯 Methyl 3-(Trifluoromethyl)benzoate,>;98.0%(GC)(2557-13-3)
  • Alfa Aesar:3-(三氟甲基)苯甲酸甲酯,97% Methyl 3-(trifluoromethyl)benzoate, 97%(2557-13-3)

系列性分类


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