Acetic Acid m-Cresyl Ester 乙酸间甲苯酯

CAS 122-46-3 MFCD00041910

化学结构图

122-46-3
SMILES: CC(=O)Oc1cccc(C)c1

化学属性

Mol. FormulaC9H10O2
Mol. Weight150
Density1.04
Boiling Point210-213
Refractive index1.4990 to 1.5020
Flash Point95°C(lit.)
TSCAYes

别名和识别编码

Chemical NameAcetic Acid m-Cresyl Ester
Synonym 3-Cr 3-METHYLPHENYLACETATE 3-Methylphenol acetate 3-Methylphenyl acetate 3-Methylphenyl ester of acetic acid 3-Tolyl acetate m-Acetoxytoluene m-Tolylacetat ACETIC ACID-3-METHYLPHENYL ESTER Acetic acid m-cresol ester Acetic acid m-tolyl ester Acetic acid, m-tolyl ester Acetic acid, m-methylphenyl ester CRESATIN Cresatin m-cresylacetate Cresatin-Sulzberger Essigsäure-m-tolylester M-CRESYL ACETATE META TOLYL ACETATE Metacresol acetate m-Acetoxytoluene m-Cresyl acetate 醋酸间甲苯酯 醋酸间甲酚酯 间甲苯乙酸酯
MDL NumberMFCD00041910
CAS Number122-46-3
PubChem Substance ID87562222
EC Number204-546-2
Merck Number2583
Beilstein Registry Number1862796
Reaxys-RN1862796
Chemical Name Translation乙酸间甲苯酯
LabNetwork Molecule IDLN00194562
InChIInChI=1S/C9H10O2/c1-7-4-3-5-9(6-7)11-8(2)10/h3-6H,1-2H3
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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

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: 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

安全信息

WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US) Eyeshields, Gloves, half-mask respirator (EU), half-mask respirator (US), multi-purpose combination respirator cartridge (US)
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触;
Warnings 危化品目录(2015) 危险化学品
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。

其他信息

  • 可燃性危险特性:明火可燃; 受热产生辛辣刺激烟雾
  • 毒性分级:中毒
  • Alfa Aesar:间甲苯乙酸酯,97% m-Tolyl acetate, 97%(122-46-3)
  • Sigma Aldrich:122-46-3(sigmaaldrich)
  • MOL 文件:122-46-3.mol
  • 储运特性:库房通风低温干燥; 与食品、氧化剂、酸类分开储运
  • 灭火剂:泡沫、干粉、二氧化碳、雾状水
  • 图谱信息:乙酸间甲苯酯(122-46-3)质谱(MS)
  • TCI Shanghai:乙酸间甲苯酯 m-Tolyl Acetate,>;99.0%(GC)(122-46-3)
  • Acros Organics:乙酸间甲苯酯 m-Tolyl acetate, 98+%(122-46-3)
  • 急性毒性:口服-大鼠 LD50: 1900 毫克/ 公斤 (参考P-CRESOL ACETATE)
  • 乙酸间甲苯酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 A0659 乙酸间甲苯酯 m-Tolyl Acetate 500G 2730元 2014/06/02 A0659 乙酸间甲苯酯 m-Tolyl Acetate 25G 334元 2010/06/21 421360050 乙酸间甲苯酯 m-Tolyl acetate 98+% 5 GR 625元
  • 类别:有毒物品

系列性分类


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