Benzopinacol 苯频哪醇

CAS 464-72-2 MFCD00004448

化学结构图

464-72-2
SMILES: OC(c1ccccc1)(c1ccccc1)C(O)(c1ccccc1)c1ccccc1

化学属性

Mol. FormulaC26H22O2
Mol. Weight366.45
Melting Point171-173 °C
TSCAYes
Solubility不溶
Appearance 白色单斜晶体。熔点197℃,222℃(分解)。易溶于沸热冰乙酸(1份溶于11.5份)、沸苯(1份溶于26份),极易溶于乙醚、二硫化碳、氯仿。
Boiling Point457.21 °C at 760 mmHg

别名和识别编码

Chemical Name1,1,2,2-Tetraphenylethane-1,2-diol
MDL NumberMFCD00004448
Synonym 1,1,2,2-Tetraphenyl-1,2-ethanediol {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {} {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {} {} {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {} {} {} {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {} {} {} {} {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {} {} {} {} {} {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1,2,2-Tetraphenyl-1,2-ethanediol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
EC Number207-356-8
CAS Number464-72-2
Merck Number1100
Beilstein Registry Number2061947
PubChem Substance ID94766
Chemical Name Translation苯频哪醇
Reaxys-RN2061947
LabNetwork Molecule IDLN00219817
Canonical SMILESOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O
InChIInChI=1S/C26H22O2/c27-25(21-13-5-1-6-14-21,22-15-7-2-8-16-22)26(28,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,27-28H
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分类

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

相关文献及参考

  • Short: III/35D2 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Carbon-13, Part 2: Aromatic Compounds Author: Mikhova, B. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35D2 Year: 2005 Keyword: aromatic compounds; carbon-13; chemical shift; coupling constant; molecular structure ISBN: 978-3-540-20189-2 ISBN: 3-540-20189-0 Internet Resource: DOI:10.1007/b83345 RefComment: VIII, 291 p., Hardcover RefComment: Written for Science and engineers in the fields of physics, chemistry and physical chemistry who inted to use NMR to study the structure and the binding of molecules Abstract: Nuclear Magnetic Resonance (NMR) is based on the fact that certain nuclei exhibit a magnetic moment, orient by a magnetic field, and absorb characteristic frequencies in the radiofrequency part of the spectrum. The spectral lines of the nuclei are highly influenced by the chemical environment i.e. the structure and interaction of the molecules. NMR is now the leading technique and a powerful tool for the investigation of the structure and interaction of molecules. The present Landolt-Börnstein volume III/35 Nuclear Magnetic Resonance (NMR) Data is therefore of major interest to all scientists and engineers who intend to use NMR to study the structure and the binding of molecules. Volume III/35 "NMR-Data" is divided into several subvolumes and parts. Subvolume III/35A contains the nuclei 11B and 31P, subvolume III/35B contains the nuclei 19F and 15N, subvolume III/35C contains the nucleus 1H,
  • Undergoes pinacol rearrangement on treatment with sulfuric acid to give ɑɑɑ-triphenylacetophenone in high yield. With the superacidic triflic acid, however, dehydrative cyclization to 9,10-diphenylphenanthrene occurs: Synthesis, 321 (1996); Org. Synth., 76, 294 (1998). The same pruduct is obtained on treatment of ɑɑɑ-triphenylacetophenone or tetraphenyloxirane with superacid mixtures: J. Org. Chem., 62, 6666 (1

安全信息

RTECSKI2750000
WGK Germany2
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触;
GHS Symbol
Precautionary statements
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛,皮肤或衣服。
  • P273 Avoid release to the environment. 避免释放到环境中。
  • P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard Class9
UN Number 3077
Signal word
Hazard statements
  • H410 Verytoxictoaquaticlifewithlonglastingeffects 对水生生物毒性非常大并具有长期影响。
Packing GroupIII
Hazard Codes Xi
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >8 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   EJTXAZ European Journal of Toxicology and Environmental Hygiene.  (Paris,
   France)  V.7-9, 1974-76. For publisher information, see TOERD9.
   Volume(issue)/page/year: 9,99,1976

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >10 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   EJTXAZ European Journal of Toxicology and Environmental Hygiene.  (Paris,
   France)  V.7-9, 1974-76. For publisher information, see TOERD9.
   Volume(issue)/page/year: 9,99,1976

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

  • 苯频哪醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 B1037 苯频哪醇 Benzopinacol 5G 195元 2014/06/02 B1037 苯频哪醇 Benzopinacol 25G 539元 2010/06/21 105591000 苯频哪醇 Benzopinacole 98% 100 GR 1579元
  • Sigma Aldrich:464-72-2(sigmaaldrich)
  • 方法一:将二苯甲酮、异丙酮和微量冰乙酸的混合物进行光照处理,能93-94%的产率结晶出四苯乙二醇。
  • 用途一:有机合成中间体。
  • 海关编码:29062900
  • Hazard Note:Irritant
  • MSDS 信息:1,1,2,2-Tetraphenyl-1,2-ethanediol(464-72-2).msds
  • 上游原料:乙酸 --> 二苯甲酮
  • MOL 文件:464-72-2.mol
  • Alfa Aesar:苯频哪醇,98% Benzopinacol, 98%(464-72-2)
  • Acros Organics:Benzopinacole, 98%(464-72-2)
  • TCI Shanghai:苯频哪醇 Benzopinacol,>;95.0%(LC)(464-72-2)

系列性分类


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