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Acetic Acid → Ethyl 2-cyano-4,4-dimethylpent-2-enoate

HRID 375102
ノート
印刷プレビュー

反応式

HRID 375102 の反応式
[CH3:1][C:2]([CH:5]=O)([CH3:4])[CH3:3].[CH2:7]([O:9][C:10](=[O:14])[CH2:11][C:12]#[N:13])[CH3:8].C(O)(=O)C.N1C=CC=CC=1>Cl>[CH2:7]([O:9][C:10](=[O:14])[C:11]([C:12]#[N:13])=[CH:1][C:2]([CH3:5])([CH3:4])[CH3:3])[CH3:8]
参加物実験手順後処理出典と根拠反応ノート

参加物

6

反応物 4

HCID 176Acetic AcidHCID 1049PyridineHCID 7764Ethyl cyanoacetateHCID 12417Pivalaldehyde2 回

生成物 1

HCID 53661853Ethyl 2-cyano-4,4-dimethylpent-2-enoate収率 73.2%

試薬・触媒・溶媒 1

HCID 313Hydrochloric Acid溶媒

実験手順

A mixture of pivaldehyde (5.00 g, 58 mmol), ethylcyanoacetate (6.60g, 58.3 mmol), acetic acid (3.50 g, 58.3 mmol) and pyridine (4.60 g, 58.2 mmol) was heated at reflux for 1 h. A second portion of pivaldehyde (5.00 g, 58 mmol) was added. The refluxing of the mixture was continued for 18h. After cooling, the mixture was poured into 1N aqueous HCl (50 mL). The resulting mixture was extracted with EtOAc (3×50 mL). The combined organic layers, were washed with 1N aqueous HCl, dried (MgSO4) and concentrated to give a colorless oil. The oil was purified by flash chromatography on SiO2 using hexane-EtOAc (9:1) as the eluant to give 2-cyano-4,4-dimethyl-2-pentenoic acid ethyl ester as a colorless oil (7.69 g, 73 % yield).

後処理

  1. temperaturewas heated
  2. temperatureat reflux for 1 h
  3. temperatureThe refluxing of the mixture
  4. temperatureAfter cooling
  5. extractionThe resulting mixture was extracted with EtOAc (3×50 mL)
  6. washThe combined organic layers, were washed with 1N aqueous HCl
  7. dry with materialdried (MgSO4)
  8. concentrationconcentrated
  9. customto give a colorless oil
  10. customThe oil was purified by flash chromatography on SiO2

出典と根拠

ORDレコード
ord-3a447c8db62f4639b43b05ce57a7ad71
出典データセット
uspto-grants-1996_01
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US05484771

反応ノート

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