Adipic Acid Monomethyl Ester 己二酸单甲酯

CAS 627-91-8 MFCD00004418

化学结构图

627-91-8
SMILES: COC(=O)CCCCC(=O)O

化学属性

Mol. FormulaC7H12O4
Mol. Weight160.17
Density1.081
Boiling Point162 °C at 10 mmHg
Melting Point7-9°C
Refractive index1.4390 to 1.4430
Flash Point>110°(230°F)
TSCAYes

别名和识别编码

Chemical NameAdipic Acid Monomethyl Ester
CAS Number627-91-8
Alfabeta NameMONOMETHYLADIPATE
MDL NumberMFCD00004418
Synonym Monomethyl adipate {LY} Monomethyl adipate {} {LY} Monomethyl adipate {} {} {LY} Monomethyl adipate {} {} {} {LY} Monomethyl adipate {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {} {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Monomethyl adipate {} {} {} {} {}
Beilstein Registry Number1766411
PubChem Substance ID160870936
EC Number211-019-0
Reaxys-RN1766411
Chemical Name Translation己二酸单甲酯
LabNetwork Molecule IDLN00010720
InChIInChI=1S/C7H12O4/c1-11-7(10)5-3-2-4-6(8)9/h2-5H2,1H3,(H,8,9)
Canonical SMILESC(C(OC)=O)CCCC(O)=O
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分类

  • {SNA} Building Blocks, C6 to C7, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks
  • {uni_hamburg} no charge; carboxylic acid; ester; 1fragment
  • Building Blocks, C6 to C7, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks

相关文献及参考

  • Beilstein: 2,III,1711
  • Short: III/38B
  • Short: IV/18B
  • Short: IV/20B
  • The formation of ketones from carboxylic acids is illustrated by the conversion of methyl hydrogen adipate to the mono-acid chloride using 1-chloro-N,N,2-trimethylpropenylamine, followed by Cu(I)-promoted reaction with butylmagnesium bromide: Chem. Lett., 1791 (1983); Org. Synth. Coll., 8, 441 (1993):

安全信息

Warnings IRRITANT
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US)
Signal word
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
Precautionary statements
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338+P337+P313
  • P332+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
GHS Symbol

其他信息

  • MSDS 信息:Monomethyl adipate(627-91-8).msds
  • Acros Organics:己二酸单甲酯 Monomethyl adipate, 98%(627-91-8)
  • 用途二:用作染料中间体
  • 海关编码:29171290
  • Alfa Aesar:己二酸氢甲酯,99% Methyl hydrogen adipate, 99%(627-91-8)
  • Sigma Aldrich:627-91-8(sigmaaldrich)
  • 己二酸单甲酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 102820050 己二酸单甲酯 Monomethyl adipate 98% 5 GR 281元 2010/06/21 102820250 己二酸单甲酯 Monomethyl adipate 98% 25 GR 857元 2010/06/21 102821000 己二酸单甲酯 Monomethyl adipate 98% 100 GR 2146元
  • 图谱信息:己二酸单甲酯(627-91-8)质谱(MS) 己二酸单甲酯(627-91-8)Raman光谱 己二酸单甲酯(627-91-8)核磁图( 13 CNMR) 己二酸单甲酯(627-91-8)核磁图( 1 HNMR) 己二酸单甲酯(627-91-8)红外图谱(IR1)
  • 用途一:广泛用于合成高级表面活性剂，用作高级润滑油和燃料的添加剂、乳化剂制品、香料的溶剂等
  • MOL 文件:627-91-8.mol

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Others 其他杂环
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Others 其他杂环
  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
  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. C6 to C7 - Esters

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