3-(Trifluoromethyl)phenylacetic acid 3-(三氟甲基)苯乙酸

CAS 351-35-9 MFCD00004339

化学结构图

351-35-9
SMILES: O=C(O)Cc1cccc(C(F)(F)F)c1

化学属性

Mol. FormulaC9H7F3O2
Mol. Weight204
Melting Point76-79
TSCAT
Density1.357
Refractive index1.4045-1.4065
Flash Point77 ºC
Boiling Point176-177 ºC
Solubility45 G/L (20 ºC)

别名和识别编码

Chemical Name3-(Trifluoromethyl)phenylacetic acid
CAS Number351-35-9
Alfabeta NameTRIFLUOROMETHYLPHENYLACETICACID 3()-
MDL NumberMFCD00004339
Synonym (A,A,A-TRIFLUORO-M-TOLYL)ACETIC ACID (ALPHA,ALPHA,ALPHA-TRIFLUORO-M-TOLYL)ACETIC ACID (ALPHA,ALPHA,ALPHA-TRIFLUORO-M-TOLYL)ACETIC ACID 98% (ALPHA,ALPHA,ALPHA-三氟-间甲苯)乙酸 (alpha,alpha,alpha-Trifluoro-m-tolyl)acetic acid (alpha,alpha,alpha-trifluoro-3-tolyl)acetic acid (α,α,α-Trifluoro-m-tolyl)acetic acid 2-(3-(TRIFLUOROMETHYL)PHENYL)ACETIC ACID 2-Methyl butyric acid 3-(TRIFLUOROMETHYL)PHENYLACETIC ACID 3-(Trifluoromethyl)phenylacetic Acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Beilstein Registry Number2213223
PubChem Substance ID87577403
EC Number206-511-7
Chemical Name Translation3-(三氟甲基)苯乙酸
Reaxys-RN2213223
InChIKeyBLXXCCIBGGBDHI-UHFFFAOYSA-N
LabNetwork Molecule IDLN00116107
InChIInChI=1S/C9H7F3O2/c10-9(11,12)7-3-1-2-6(4-7)5-8(13)14/h1-4H,5H2,(H,13,14)
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分类

  • Building Blocks, C9, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks
  • {SNA} Building Blocks, C9, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks

产品应用

  • 是一种用于合成医药及农用化学品的中间体。

相关文献及参考

  • Beilstein:9(3)2430

安全信息

Warnings IRRITANT
Precautionary statements
  • 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。
  • 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+P350
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • 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
WGK Germany3
GHS Symbol
Signal word Warning
Hazard statements
  • 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
Hazard Codes C Xi
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
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 Wear suitable protective clothing 穿戴适当的防护服；
  • 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 Wear suitable gloves 戴适当手套；
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
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
UN Number 3265

其他信息

  • 图谱信息:间三氟甲基苯乙酸(351-35-9)Raman光谱 间三氟甲基苯乙酸(351-35-9)质谱(MS) 间三氟甲基苯乙酸(351-35-9)红外图谱(IR2) 间三氟甲基苯乙酸(351-35-9)红外图谱(IR1) 间三氟甲基苯乙酸(351-35-9)核磁图( 1 HNMR) 间三氟甲基苯乙酸(351-35-9)核磁图( 13 CNMR)
  • 用途三:是一种用于合成医药及农用化学品的中间体。
  • 间三氟甲基苯乙酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 T1662 3-(三氟甲基)苯乙酸 3-(Trifluoromethyl)phenylacetic Acid 25G 1400元 2014/06/02 T1662 3-(三氟甲基)苯乙酸 3-(Trifluoromethyl)phenylacetic Acid 5G 449元 2010/06/21 185870500 间三氟甲基苯乙酸 (alpha,alpha,alpha-Trifluoro-m-tolyl)acetic acid 98% 50 GR 4853元
  • 用途二:有机中间体。
  • TSCA:T
  • MOL 文件:351-35-9.mol
  • Hazard Note:Irritant
  • Sigma Aldrich:351-35-9(sigmaaldrich)
  • 用途一:用作有机合成中间体
  • Alfa Aesar:3-(三氟甲基)苯乙酸,98+% 3-(Trifluoromethyl)phenylacetic acid, 98+%(351-35-9)
  • TCI Shanghai:3-(三氟甲基)苯乙酸 3-(Trifluoromethyl)phenylacetic Acid,>;98.0%(T)(351-35-9)
  • Acros Organics:(alpha,alpha,alpha-三氟-间甲苯）乙酸 (alpha,alpha,alpha-Trifluoro-m-tolyl)acetic acid, 98%(351-35-9)

系列性分类

  1. Chemical Synthesis 化学合成
  2. Organometallic Reagents 金属有机试剂
  3. Boronic Acids and Derivatives 硼酸和硼酸衍生物
  4. Boronic Acids 硼酸
  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. Trifluoromethyl 三氟甲基
  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. Carboxylic Acids - Carbonyl Compounds
  6. C9 - Carboxylic Acids
  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
  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. Aromatic acids
  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. Carboxylic Acids
  6. C8