4-(Trifluoromethyl)benzoic Acid 对三氟甲基苯甲酸

CAS 455-24-3 MFCD00002562

化学结构图

455-24-3
SMILES: O=C(O)c1ccc(C(F)(F)F)cc1

化学属性

Mol. FormulaC8H5F3O2
Mol. Weight190.12
Boiling Point243.2°C at 760 mmHg
Melting Point219-220°C
TSCAT
Density1.403
Flash Point247°C/753mm
Appearance 白色粉末状固体。

别名和识别编码

Chemical Name4-(Trifluoromethyl)benzoic Acid
CAS Number455-24-3
Alfabeta NameTRIFLUOROMETHYLBENZOICACID 4()-
MDL NumberMFCD00002562
Synonym 4-(Trifluoromethyl)benzoic acid {LY} 4-(Trifluoromethyl)benzoic acid {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {} {} { {} {} {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {} {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {} {} {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {} {} {} {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {} {} {} {} {} {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-(Trifluoromethyl)benzoic acid {} {}
Beilstein Registry Number2049241
PubChem Substance ID9966
EC Number207-242-8
Reaxys-RN2049241
Chemical Name Translation对三氟甲基苯甲酸
InChIKeySWKPKONEIZGROQ-UHFFFAOYSA-N
InChIInChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-5(2-4-6)7(12)13/h1-4H,(H,12,13)
LabNetwork Molecule IDLN00115860
Canonical SMILESC1=C(C=CC(=C1)C(O)=O)C(F)(F)F
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分类

  • Building Blocks, C8, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks
  • {SNA} Building Blocks, C8, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks

相关文献及参考

  • Beilstein:9(3)2355
  • Beilstein:10(4)619

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。
  • P264+P265
  • 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+P350
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • 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。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • 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
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
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 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；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
  • 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；
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
Storage condition 2-8°C {LY} 2-8°C Store at room temperature {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°

其他信息

  • 海关编码:29163900
  • 4-三氟甲基苯甲酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 T1145 4-（三氟甲基）苯甲酸 4-(Trifluoromethyl)benzoic Acid 5G 80元 2014/06/02 T1145 4-（三氟甲基）苯甲酸 4-(Trifluoromethyl)benzoic Acid 25G 190元 2010/06/21 188460050 4-三氟甲基苯甲酸 4-(Trifluoromethyl)benzoic acid 98% 5 GR 565元
  • Acros Organics:4-(三氟甲基)苯甲酸 alpha,alpha,alpha-Trifluoro-p-toluic acid, 98%(455-24-3)
  • TSCA:T
  • Sigma Aldrich:455-24-3(sigmaaldrich)
  • 图谱信息:4-三氟甲基苯甲酸(455-24-3)红外图谱(IR1) 4-三氟甲基苯甲酸(455-24-3)质谱(MS) 4-三氟甲基苯甲酸(455-24-3)核磁图( 1 HNMR) 4-三氟甲基苯甲酸(455-24-3)红外图谱(IR2) 4-三氟甲基苯甲酸(455-24-3)核磁图( 13 CNMR)
  • Hazard Note:Irritant
  • 下游产品:4-三氟甲基苯异氰酸
  • TCI Shanghai:4-三氟甲基苯甲酸 4-(Trifluoromethyl)benzoic Acid,>;98.0%(T)(455-24-3)
  • 检测方法:GC,NMR
  • MSDS 信息:4-Carboxybenzotrifluoride(455-24-3).msds
  • MOL 文件:455-24-3.mol
  • Alfa Aesar:4-(三氟甲基)苯甲酸,98+% 4-(Trifluoromethyl)benzoic acid, 98+%(455-24-3)

系列性分类

  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. C8 - 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. C7

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