4-Bromophenylacetic Acid 4-溴苯基乙酸

CAS 1878-68-8 MFCD00004342

化学结构图

1878-68-8
SMILES: O=C(O)Cc1ccc(Br)cc1

化学属性

Mol. FormulaC8H7BrO2
Mol. Weight215.04
Melting Point114-117°C
Density1.616
TSCAYes
Solubility略溶于水
Stability对光敏感
Appearance 白色固体,熔点117-119℃,微溶于水.
Boiling Point326°C at 760 mmHg

别名和识别编码

Chemical Name4-Bromophenylacetic Acid
CAS Number1878-68-8
Alfabeta NameBROMOPHENYLACETICACID 4-
MDL NumberMFCD00004342
Synonym 4-Bromobenzeneacetic acid {LY} 4-Bromobenzeneacetic acid {} {LY} 4-Bromobenzeneacetic acid {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromobenzeneacetic acid {} {} {} {} {} {} {} {} {} {}
Beilstein Registry Number972146
PubChem Substance ID87564230
EC Number217-523-7
Reaxys-RN972146
Chemical Name Translation4-溴苯基乙酸
InChIKeyQOWSWEBLNVACCL-UHFFFAOYSA-N
Wiswesser Line NotationQV1R DE
LabNetwork Molecule IDLN00005081
InChIInChI=1S/C8H7BrO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
Canonical SMILESBrC1=CC=C(CC(O)=O)C=C1
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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:9,451

安全信息

Warnings IRRITANT
WGK Germany3
GHS Symbol
Signal word Warning
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H302 Harmful if swallowed 吞食有害
Hazard Codes Xn Xn,Xi Xi
RTECSAF6325000
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
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。
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
  • 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+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P332+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
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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1050 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia,
   Italy)  V.8-43 1953-88 For publisher information, see FRMCE8
   Volume(issue)/page/year: 13,286,1958

其他信息

  • 海关编码:29163900
  • Alfa Aesar:4-溴苯基-乙酸,99% 4-Bromophenylacetic acid, 99%(1878-68-8)
  • MOL 文件:1878-68-8.mol
  • Sigma Aldrich:1878-68-8(sigmaaldrich)
  • 对溴苯乙酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 xw010166 4-溴苯乙酸 25g 300元 2011/04/16 B1296 4-溴苯基乙酸 4-Bromophenylacetic Acid 250G 4510元 2011/04/16 B1296 4-溴苯基乙酸 4-Bromophenylacetic Acid 25G 883元
  • 图谱信息:对溴苯乙酸(1878-68-8)红外图谱(IR1) 对溴苯乙酸(1878-68-8)核磁图( 13 CNMR) 对溴苯乙酸(1878-68-8)质谱(MS) 对溴苯乙酸(1878-68-8)核磁图( 1 HNMR) 对溴苯乙酸(1878-68-8)红外图谱(IR2)
  • Acros Organics:对溴苯乙酸 4-Bromophenylacetic acid, 99%(1878-68-8)
  • MSDS 信息:4-Bromophenylacetic acid(1878-68-8).msds
  • Hazard Note:Irritant
  • TCI Shanghai:4-溴苯基乙酸 4-Bromophenylacetic Acid,>;98.0%(GC)(T)(1878-68-8)
  • 下游产品:2-(4-溴苯基)-2-甲基丙酸 --> 对溴苯乙酸乙酯

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. 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