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


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