2-Bromo-4-methylphenol 2-溴-4-甲基苯酚

CAS 6627-55-0 MFCD00002151

化学结构图

6627-55-0
SMILES: Cc1ccc(O)c(Br)c1

化学属性

Mol. FormulaC7H7BrO
Mol. Weight187.03
Density1.547
Refractive index1.5760 to 1.5820
Flash Point>110°(230°F)
TSCAYes
Boiling Point213-214°C at 760 mmHg
Melting Point54-55 °C
Stability对空气敏感

别名和识别编码

Chemical Name2-Bromo-4-methylphenol
CAS Number6627-55-0
Alfabeta NameBROMOMETHYLPHENOL 24---
MDL NumberMFCD00002151
Synonym 2-Bromo-4-methylphenol {LY} 2-Bromo-4-methylphenol {} {LY} 2-Bromo-4-methylphenol {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-4-methylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Br
EC Number229-595-7
PubChem Substance ID23109
Reaxys-RN1859036
Beilstein Registry Number6,405
Chemical Name Translation2-溴-4-甲基苯酚
InChIKeyMTIDYGLTAOZOGU-UHFFFAOYSA-N
LabNetwork Molecule IDLN00011250
InChIInChI=1S/C7H7BrO/c1-5-2-3-7(9)6(8)4-5/h2-4,9H,1H3
Canonical SMILESCC1=CC(Br)=C(O)C=C1
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分类

  • {SNA} Building Blocks, C6 to C8, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds, Phenols
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; alcohol; 1fragment

相关文献及参考

  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15
  • Short: III/38B Title: Refractive Indices of Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/38B Year: 1996 Keyword: organic compounds; refractive index; liquids ISBN: 3-540-60596-7 ISBN: 978-3-540-60596-6 Internet Resource: DOI:10.1007/b85533 RefComment: VII, 4210 pages, Hardcover Abstract: Volume III/38 Optical Constants provides critically evaluated data on refractive indices of inorganic and organic liquids and their wavelength dependence (dispension). Part A contains the inorganic, organometallic, and organononmetallic liquids, and the binary liquid mixtures (about 900 pure substances and their mixtures). Part B contains data of more than 7600 organic liquids.

安全信息

Warnings IRRITANT
RTECSGO6868200
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
  • R21/22 Harmful in contact with skin and if swallowed 皮肤接触和不慎吞咽有害
Safety Statements
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
  • 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；
  • S36/37/39 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；
GHS Symbol
WGK Germany3
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
Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Precautionary statements
  • 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。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338
  • P305+P351+P338+P337+P313
Signal word
Hazard Codes Xn Xi Xi,Xn
Storage condition 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°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 195 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 18,868,1975

其他信息

  • 上游原料:稀硫酸 --> 4-甲基苯酚 --> 2-溴-4-甲基苯胺
  • 2-溴-4-甲基苯酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 B0808 2-溴对甲基苯酚 2-Bromo-p-cresol 500G 6900元 2014/06/02 B0808 2-溴对甲基苯酚 2-Bromo-p-cresol 25G 991元 2010/06/21 107140250 2-溴-4-甲基苯酚 2-Bromo-4-methylphenol 96% 25 GR 1119元
  • MOL 文件:6627-55-0.mol
  • MSDS 信息:2-Bromo-4-methylphenol(6627-55-0).msds
  • Sigma Aldrich:6627-55-0(sigmaaldrich)
  • Alfa Aesar:2-溴-4-甲基苯酚,97% 2-Bromo-4-methylphenol, 97%(6627-55-0)
  • 方法一:由2-溴-4-甲基苯胺重氮化、水解而得。将稀硫酸加到2-溴-4-甲基苯胺中，搅拌冷却，在5℃以下加入亚硝酸钠水溶液，温度保持在5℃以下，然后再加冷水、尿素和碎冰，得重氮盐溶液。再将无水硫酸钠、浓硫酸和水加热，在130-135℃分批加入重氮盐溶液，然后分批加入水进行蒸馏，所得馏出液用乙醚萃取，用10%碳酸氢钠溶液洗涤，再经无水硫酸钠干燥，过滤，滤液蒸去乙醚而得成品。另一种方法是由对甲苯酚在氯仿溶剂中直接溴化。
  • 用途一:有机合成中间体。
  • TCI Shanghai:2-溴-4-甲基苯酚 2-Bromo-p-cresol,>;98.0%(GC)(6627-55-0)
  • Hazard Note:Irritant
  • 图谱信息:2-溴-4-甲基苯酚(6627-55-0)Raman光谱 2-溴-4-甲基苯酚(6627-55-0)核磁图( 1 HNMR) 2-溴-4-甲基苯酚(6627-55-0)质谱(MS) 2-溴-4-甲基苯酚(6627-55-0)红外图谱(IR1) 2-溴-4-甲基苯酚(6627-55-0)核磁图( 13 CNMR)
  • Acros Organics:2-溴-4-甲基苯酚 2-Bromo-4-methylphenol, 96%(6627-55-0)

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. Oxygen Compounds 氧化合物
  5. Phenols 酚类
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Phenols 酚类
  6. C6 to C8 - Phenols
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Protected Alcohols/Phenols - Oxygen Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Ethers

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