2,3,6-Trifluorobenzoic Acid 2,3,6-三氟苯甲酸

CAS 2358-29-4 MFCD00002409

化学结构图

2358-29-4
SMILES: O=C(O)c1c(F)ccc(F)c1F

化学属性

Mol. FormulaC7H3F3O2
Mol. Weight176.09
Melting Point130-131°C
TSCANo
Density1.422
Appearance 白色固体。熔点130℃-131℃。
Boiling Point233.5°C at 760 mmHg

别名和识别编码

Chemical Name2,3,6-Trifluorobenzoic Acid
MDL NumberMFCD00002409
PubChem Substance ID520062
CAS Number2358-29-4
Reaxys-RN2579153
Beilstein Registry Number2579153
Synonym 2,3,6-Trifluorobenzoic acid {LY} 2,3,6-Trifluorobenzoic acid {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {} {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {} {} {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {} {} {} {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {} {} {} {} {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,6-Trifluorobenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,6-Trifluoro
EC Number250-023-7
Chemical Name Translation2,3,6-三氟苯甲酸
LabNetwork Molecule IDLN00217734
InChIInChI=1S/C7H3F3O2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2H,(H,11,12)
Canonical SMILESO=C(O)C1=C(F)C=CC(F)=C1F
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分类

  • Aryl Fluorinated Building Blocks, Building Blocks, C7, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Fluorinated Building Blocks, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
  • {SNA} Aryl Fluorinated Building Blocks, Building Blocks, C7, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Fluorinated Building Blocks, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks

相关文献及参考

  • FT-IR 2 (2), 2707:C / FT-NMR 1 (2), 1140:B / RegBook 1 (2), 1817:H / Structure Index 1 , 291:E:1 / Vapor Phase 3 , 1332:B

安全信息

WGK Germany3
GHS Symbol
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。
  • P305+P351+P338
  • P305+P351+P338+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
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
Signal word Warning
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;
  • S37 Wear suitable gloves 戴适当手套;
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护;
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 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

  • TCI Shanghai:2,3,6-三氟苯甲酸 2,3,6-Trifluorobenzoic Acid,>;98.0%(T)(2358-29-4)
  • MOL 文件:2358-29-4.mol
  • 上游原料:四氢呋喃 --> 正丁基锂 --> 二氧化碳 --> 1,2,4-三氟苯
  • Hazard Note:Irritant
  • 用途一:医药、农药、液晶材料中间体。
  • Alfa Aesar:2,3,6-三氟苯甲酸,99% 2,3,6-Trifluorobenzoic acid, 99%(2358-29-4)
  • Sigma Aldrich:2358-29-4(sigmaaldrich)

系列性分类


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