(2-Bromovinyl)benzene β-溴苯乙烯

CAS 103-64-0 MFCD00000185

化学结构图

103-64-0
SMILES: BrC=Cc1ccccc1

化学属性

Mol. FormulaC8H7Br
Mol. Weight183.048
Refractive index1.6030 to 1.6100
Boiling Point220.9±9.0 °C
Density1.427
Melting Point7 °C
Flash Point101.7 °C
TSCAYes
Appearance 淡黄色液体。熔点7℃,沸点219-220℃,108℃(2.67kPa),相对密度1.4269(16℃),折光率1.6066。能溶于4份90%醇,不溶于水,易聚合。闪点79℃。

别名和识别编码

Chemical Name(2-Bromovinyl)benzene
MDL NumberMFCD00000185
CAS Number103-64-0
Synonym β-Bromostyrene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID5314126
EC Number203-131-3
Beilstein Registry Number2038495
Reaxys-RN1903529
Chemical Name Translationβ-溴苯乙烯
Wiswesser Line NotationE1U1R
LabNetwork Molecule IDLN00008685
InChIInChI=1S/C8H7Br/c9-7-6-8-4-2-1-3-5-8/h1-7H/b7-6+
Canonical SMILESBr/C=C/C1=CC=CC=C1
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; 1fragment
  • {SNA} Alkenyl, Building Blocks, Chemical Synthesis, Halogenated Hydrocarbons, Organic Building Blocks

相关文献及参考

  • Short: II/14a Title: Molecular Constants: Diamagnetic Molecules Author: Demaison, J.; Dubrulle, A.; Hüttner, W.; Tiemann, E. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: II/14a Page: 1-788 Year: 1982 Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy ISBN: 3-540-11365-7 ISBN: 978-3-540-11365-2 Internet Resource: DOI:10.1007/b19966 RefComment: 196 figs., XI
  • Short: III/20b Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei Cl ... Rb Author: Chihara, H.; Nakamura, N. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/20b Year: 1988 Keyword: NQR ISBN: 3-540-18483-X ISBN: 978-3-540-18483-6 Internet Resource: DOI:10.1007/b86664 RefComment: IX,717 pages. Hardcover Abstract: Nuclear Quadrupole Resonance Spectroscopy has become a standard method for structural research in molecular and solid state physics as well as for different branches of chemistry. The volumes cover data for more than 8,000 substances in the solid state. Data for free molecules have been published in volumes II/14 and II/15 of the New Series. The tables are arranged according to the atomic number of the elements.
  • 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 or

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H302 Harmful if swallowed 吞食有害
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSWL3850000
Signal word
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
Safety Statements
  • S23 Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer) 不要吸入气体/烟雾/蒸汽/喷雾;
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套;
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触;
  • 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;
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
Hazard Codes 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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Precautionary statements
  • P301+P312+P330
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • 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。
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛,皮肤或衣服。
  • 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。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1250 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 11,1043,1973

其他信息

  • 急性毒性:口服- 大鼠 LD50: 1250 毫克/ 公斤
  • 方法一:由肉桂酸溴化而得。在肉桂酸中加入溴素,生成二溴代肉桂酸,再加入碳酸钠并经水蒸气蒸馏,同时进行脱CO2与脱HBr而生成溴代苏合香烯。产率约80%。
  • 毒性分级:中毒
  • 用途三:具强烈的素花馨。为卤代烃类香料的代表性产品,天然不存在,均由人工合成。该品的香调不属最上品,因此高级香精均未采用,但因其价格适中,故常用作皂用香精。
  • beta-溴苯乙烯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 B0655 β-溴苯乙烯 (顺反异构体混和物) beta-Bromostyrene (cis- and trans- mixture) 25G 493元 2010/06/21 169290050 beta-溴苯乙烯 beta-Bromostyrene 97%, mixture of cis/trans isomers 5 ML 653元 2010/06/21 169291000 beta-溴苯乙烯 beta-Bromostyrene 97%, mixture of cis/trans isomers 100 ML 7436元
  • Acros Organics:beta-溴苯乙烯 beta-Bromostyrene, mixture of cis/trans isomers, 97%(103-64-0)
  • 用途一:用作香料中间体
  • 类别:易燃液体
  • 储运特性:包装完整、轻装轻放; 库房通风、远离明火、高温、与氧化剂分开存放
  • MOL 文件:103-64-0.mol
  • 可燃性危险特性:遇明火、高温、强氧化剂可燃; 燃烧产生有毒溴化物烟雾
  • 下游产品:苯乙炔
  • Alfa Aesar:1-苯基-2-溴-乙烯,顺式+反式,98% beta-Bromostyrene, cis + trans, 96%(103-64-0)
  • 上游原料:肉桂基溴
  • color:very deep green-yellow
  • 图谱信息:beta-溴苯乙烯(103-64-0)质谱(MS) beta-溴苯乙烯(103-64-0)红外图谱(IR1) beta-溴苯乙烯(103-64-0)核磁图( 1 HNMR)
  • 用途二:多用于香皂或洗衣粉加香。也用于紫丁香、水仙、黄水仙、葵花、甜豆花、香薇等香型中。
  • TCI Shanghai:β-溴苯乙烯 (顺反异构体混合物) beta-Bromostyrene (cis- and trans- mixture),>;95.0%(GC)(103-64-0)
  • 灭火剂:泡沫、二氧化碳、干粉、砂土、雾状水
  • Sigma Aldrich:103-64-0(sigmaaldrich)

系列性分类


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