Methyl DL-mandelate DL-扁桃酸甲酯

CAS 4358-87-6 MFCD00004493

化学结构图

4358-87-6
SMILES: COC(=O)C(O)c1ccccc1

化学属性

Mol. FormulaC9H10O3
Mol. Weight166.17
Density1.182
Boiling Point258.1°C at 760 mmHg
Melting Point54-58°C
Flash Point113.1°C
TSCAYes
Solubilitymethanol: 0.1 g/mL, clear

别名和识别编码

Chemical NameMethyl DL-mandelate
Synonym Methyl DL-mandelate {LY} Methyl DL-mandelate {} {LY} Methyl DL-mandelate {} {} {LY} Methyl DL-mandelate {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {} {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {} {} {} {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl DL-mandelate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} M
MDL NumberMFCD00004493
CAS Number4358-87-6
EC Number224-434-7
Beilstein Registry Number2047558
PubChem Substance ID78066
Reaxys-RN2047558
Chemical Name TranslationDL-扁桃酸甲酯
InChIKeyITATYELQCJRCCK-UHFFFAOYSA-N
LabNetwork Molecule IDLN00196228
InChIInChI=1S/C9H10O3/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6,8,10H,1H3
Canonical SMILESO=C(OC)C(O)C1=CC=CC=C1
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分类

  • {SNA} Building Blocks, C8 to C9, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ester; alcohol; racemate; 1fragment

相关文献及参考

  • Beilstein:10,202
  • Short: IV/1a
  • Short: EINECS

安全信息

Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • 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;
  • S22 Do not breathe dust 不要吸入粉尘;
  • 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
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
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
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

  • 图谱信息:DL-扁桃酸甲酯(4358-87-6)红外图谱(IR2) DL-扁桃酸甲酯(4358-87-6)红外图谱(IR3) DL-扁桃酸甲酯(4358-87-6)红外图谱(IR1) DL-扁桃酸甲酯(4358-87-6)Raman光谱 DL-扁桃酸甲酯(4358-87-6)质谱(MS)
  • Acros Organics:DL-扁桃酸甲酯 DL-Methyl mandelate, 97%(4358-87-6)
  • MSDS 信息:Methyl DL-mandelate(4358-87-6).msds
  • TCI Shanghai:DL-扁桃酸甲酯 Methyl DL-Mandelate,>;98.0%(GC)(4358-87-6)
  • Sigma Aldrich:4358-87-6(sigmaaldrich)
  • DL-扁桃酸甲酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M0040 DL-扁桃酸甲酯 Methyl DL-Mandelate 25G 200元 2014/06/02 M0040 DL-扁桃酸甲酯 Methyl DL-Mandelate 500G 2040元 2010/06/21 127105000 DL-扁桃酸甲酯 DL-Methyl mandelate 97% 500 GR 3402元
  • Alfa Aesar:(±)-扁桃酸甲酯,97% (+/-)-Methyl mandelate, 97%(4358-87-6)
  • 海关编码:29181980
  • MOL 文件:4358-87-6.mol

系列性分类


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