Ethyl 3-Methylbenzoate 3-甲基苯甲酸乙酯

CAS 120-33-2 MFCD00009114

化学结构图

120-33-2
SMILES: CCOC(=O)c1cccc(C)c1

化学属性

Mol. FormulaC10H12O2
Mol. Weight164.20
Density1.03 g/mL at 25 °C(lit.)
Refractive indexn20/D 1.506(lit.)
Flash Point101°(213°F)
TSCANo
Boiling Point110 °C at 20 mmHg
Appearance 无色液体。 密度 1.03,沸点 110°C (20 mmHg),折射率 1.5055-1.5075,闪点 101°C

别名和识别编码

Chemical NameEthyl 3-Methylbenzoate
Synonym Ethyl 3-methylbenzoate {LY} Ethyl 3-methylbenzoate {} {LY} Ethyl 3-methylbenzoate {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {} {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-methylbenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-me
MDL NumberMFCD00009114
CAS Number120-33-2
EC Number204-386-3
Beilstein Registry Number1863739
PubChem Substance ID24855259
Chemical Name Translation3-甲基苯甲酸乙酯
InChIKeyWSJNYOVBJSOQST-UHFFFAOYSA-N
LabNetwork Molecule IDLN00235885
Canonical SMILESCC1=CC(C(OCC)=O)=CC=C1
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ester; 1fragment
  • {SNA} Building Blocks, C10 to C11, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks

相关文献及参考

  • Short: II/27B Title: Diamagnetic Susceptibility of Organic Compounds, Oils, Paraffins and Polyethylenes Author: Kumar, M.; Gupta, R. Editor: Gupta, Radha Raman Source: Landolt-Börnstein, New Series Volume: II/27B Year: 2008 Keyword: diamagnetic susceptibility; organic compounds ISBN: 978-3-540-44359-9 (print) ISBN: 978-3-540-45860-9 (online) Internet Resource: doi:10.1007/978-3-540-45860-9 RefComment: VIII, 503 p. With CD-ROM., Hardcover RefComment: Written for: Scientists and researchers in the fields of physics, chemistry, materials science RefComment: Supplement and Revised Editon to II/16 Abstract: The volume II/27 has been divided into three subvolumes according to the classes of compounds: Subvolume A: Diamagnetic susceptibility and magnetic anisotropy of inorganic and organometallic compounds; Subvolume B: Diamagnetic susceptibility of organic compounds, oils, paraffins and polyethylenes; Subvolume C: Diamagnetic susceptibility and magnetic anisotropy of organic compounds. The data presented in this volume are based on the literature survey of the chemical abstracts up to 2005. The calculated values of diamagnetic susceptibility of organic compounds in the present subvolume II/27B are presented along with their experimental values. They have been calculated with the use of structural parameters in structural formula by using different theoretical methods available in the literature.
  • 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 th

安全信息

WGK Germany3
GHS Symbol
Precautionary statements
  • 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
Signal word Warning
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
Hazard Codes Xi
Safety Statements
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
  • 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；
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
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
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

  • 用途二:有机合成中间体。
  • 下游产品:
  • Sigma Aldrich:120-33-2(sigmaaldrich)
  • Alfa Aesar:间甲基苯甲酸乙酯,98+% Ethyl m-toluate, 98+%(120-33-2)
  • 3-甲基苯甲酸乙酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 B23925 间甲基苯甲酸乙酯, 98+% Ethyl m-toluate, 98+% 25g 272元 2010/05/25 B23925 间甲基苯甲酸乙酯, 98+% Ethyl m-toluate, 98+% 100g 717元
  • 图谱信息:3-甲基苯甲酸乙酯(120-33-2)红外图谱(IR1) 3-甲基苯甲酸乙酯(120-33-2)质谱(MS) 3-甲基苯甲酸乙酯(120-33-2)核磁图( 13 CNMR)
  • MOL 文件:120-33-2.mol
  • 用途一:用作医药、农药、染料中间体

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. Carbonyl Compounds 羰基化合物
  5. Esters - Carbonyl Compounds
  6. C10 to C11 - Esters

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