1-(2-methylphenyl)ethanol 1-(2-甲基苯基)乙醇

CAS 7287-82-3 MFCD00046632

化学结构图

7287-82-3
SMILES: Cc1ccccc1C(C)O

化学属性

Mol. FormulaC9H12O
Mol. Weight136.19
Refractive index1.5315
TSCANo
Boiling Point78-80 °C at 2 mmHg

别名和识别编码

Chemical Name1-(2-methylphenyl)ethanol
MDL NumberMFCD00046632
CAS Number7287-82-3
Synonym 1-(o-Tolyl)ethan-1-ol {LY} 1-(o-Tolyl)ethan-1-ol {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(o-Tolyl)ethan-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
EC Number230-716-0
Beilstein Registry Number2205145
Chemical Name Translation1-(2-甲基苯基)乙醇
InChIKeySDCBYRLJYGORNK-UHFFFAOYSA-N
LabNetwork Molecule IDLN00240956
PubChem Substance ID110953
InChIInChI=1S/C9H12O/c1-7-5-3-4-6-9(7)8(2)10/h3-6,8,10H,1-2H3
Canonical SMILESOC(C)C1=CC=CC=C1C
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; alcohol; racemate; 1fragment
  • Alcohols, Building Blocks, C9 to C10, Chemical Synthesis, New Products for Chemical Synthesis, Organic Building Blocks, Oxygen Compounds
  • {SNA} Alcohols, Building Blocks, C9 to C10, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds

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, subvolume III/35D contains the nucleus 13C, subvolume III/35E contains the nucleus 17O, and subvolume III/35G contains the nucleus 77Se. More nuclei will be presented later.
  • 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.e

安全信息

GHS Symbol
WGK Germany3
Precautionary statements
  • P305+P351+P338
Signal word Warning
Hazard Codes Xn
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
  • R22 Harmful if swallowed 吞咽有害
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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

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. Alcohols - Oxygen Compounds
  6. C9 to C10 - Alcohols

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