Ethyl 4-Oxocyclohexanecarboxylate 对环己酮甲酸乙酯

CAS 17159-79-4 MFCD00013285

化学结构图

17159-79-4
SMILES: CCOC(=O)C1CCC(=O)CC1

化学属性

Mol. FormulaC9
Mol. Weight170
Boiling Point152°C/40mmHg(lit.)
Refractive index1.4560 to 1.4600
Density1.068 g/mL at 25 °C(lit.)
TSCANo
Flash Point>110 ºC
Solubility不溶

别名和识别编码

Chemical NameEthyl 4-Oxocyclohexanecarboxylate
CAS Number17159-79-4
Alfabeta NameETHYLOXOCYCLOHEXANECARBOXYLATE 4-
MDL NumberMFCD00013285
Synonym 对环己酮甲酸乙酯 Ethyl 4-cyclohexanonecarboxylate Ethyl cyclohexanone-4-carboxylate 4-环己酮甲酸乙酯 ######## 4-氧代环己基甲酸乙酯 4-环己酮甲酸乙酯 4-氧代环己基甲酸乙酯
PubChem Substance ID87566527
Beilstein Registry Number10(4)2600
Reaxys-RN2520501
Chemical Name Translation对环己酮甲酸乙酯
InChIKeyZXYAWONOWHSQRU-UHFFFAOYSA-N
LabNetwork Molecule IDLN00009426
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分类

  • Pharmaceuticals
  • Aliphatics
  • Intermediates & Fine Chemicals
  • {SNA} Building Blocks, C8 to C9, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks

产品应用

  • A cyclohexanone derivative used in the study of cyclohexanone monooxygenase and its mutants as catalysts.

相关文献及参考

  • Rial, D.V. et al.: Eur. J. Org. Chem., 7, 1203 (2008); Kayser, M.M. et al.: J. Org. Chem., 71, 8424 (2006);

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
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
Precautionary statements
  • 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。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P302+P352+P332+P313+P362+P364
  • P332+P313
  • P305+P351+P338+P337+P313
  • P302+P350
  • 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
  • P337+P313
Signal word Warning
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
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;
  • S37 Wear suitable gloves 戴适当手套;
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护;
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
Hazard Codes Xi

系列性分类


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