Methyl 2-bromobenzoate 邻溴苯甲酸甲酯

CAS 610-94-6 MFCD00016328

化学结构图

610-94-6
SMILES: COC(=O)c1ccccc1Br

化学属性

Mol. FormulaC8H7BrO2
Mol. Weight215.04
Density1.532
Boiling Point241°C at 760 mmHg
Refractive index1.5580 to 1.5600
Flash Point>110°(230°F)
TSCAYes
Solubility不溶
Appearance 浅黄色透明液体。密度 1.51 ,沸点 252-254°C ,折射率 1.5575-1.5595 ,水溶性 insoluble
pH:A
Melting Point252 °C

别名和识别编码

Chemical NameMethyl 2-Bromobenzoate
CAS Number610-94-6
Alfabeta NameMETHYLBROMOBENZOATE 2-
MDL NumberMFCD00016328
PubChem Substance ID11894
EC Number210-241-5
Beilstein Registry Number1862501
Reaxys-RN1862501
Synonym Methyl 2-bromobenzoate {LY} Methyl 2-bromobenzoate {} {LY} Methyl 2-bromobenzoate {} {} {LY} Methyl 2-bromobenzoate {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 2-bromobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 2-bro
Chemical Name Translation邻溴苯甲酸甲酯
InChIKeySWGQITQOBPXVRC-UHFFFAOYSA-N
LabNetwork Molecule IDLN00009073
InChIInChI=1S/C8H7BrO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3
Canonical SMILESC1=CC=CC(=C1C(OC)=O)Br
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ester; 1fragment
  • {SNA} Building Blocks, C8 to C9, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks
  • Building Blocks, C8 to C9, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks

相关文献及参考

  • Short: II/27B
  • Beilstein:9(3)1385
  • Short: III/20b
  • Heck reaction with acrylonitrile results in lactonization to give the benzofuran-2-one 3-(cyanomethyl)-2-coumaranone: J. Heterocycl. Chem., 32, 1587 (1995):

安全信息

Warnings IRRITANT
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves
Signal word Warning
GHS Symbol
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
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
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。
  • P264+P265
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • 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。
  • P301+P312
  • P301+P317
  • P302+P352
  • P304+P312
  • P304+P340
  • P305+P351+P338
  • 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。
  • P317
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P322 Specific measures (see …on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • 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
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard Codes Xi
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H332 Harmful if inhaled 吸入有害
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
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-溴苯甲酸甲酯 Methyl 2-Bromobenzoate,>;98.0%(GC)(610-94-6)
  • Alfa Aesar:2-溴苯甲酸甲酯,99% Methyl 2-bromobenzoate, 99%(610-94-6)
  • MSDS 信息:Methyl 2-bromobenzoate(610-94-6).msds
  • Sigma Aldrich:610-94-6(sigmaaldrich)
  • 图谱信息:邻溴苯甲酸甲酯(610-94-6)红外图谱(IR1) 邻溴苯甲酸甲酯(610-94-6)核磁图( 13 CNMR) 邻溴苯甲酸甲酯(610-94-6)核磁图( 1 HNMR) 邻溴苯甲酸甲酯(610-94-6)质谱(MS)
  • 邻溴苯甲酸甲酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 B0555 2-溴苯甲酸甲酯 Methyl 2-Bromobenzoate 25G 416元 2014/06/02 B0555 2-溴苯甲酸甲酯 Methyl 2-Bromobenzoate 250G 2460元 2010/06/21 249810500 邻溴苯甲酸甲酯 Methyl 2-bromobenzoate 98% 50 ML 972元
  • Acros Organics:2-溴苯甲酸甲酯 Methyl 2-bromobenzoate, 98%(610-94-6)
  • MOL 文件:610-94-6.mol
  • 不溶于水。

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. Esters - Carbonyl Compounds
  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. Esters - Carbonyl Compounds
  6. C8 to C9 - Esters
  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. Esters
  6. C6 to C7