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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Acetic Acid → HCID 178429255, 화합물

HRID 910337
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HRID 910337 반응식
[Cl-].[CH3:2][C:3]1[CH:4]=[C:5]([NH:10][NH3+:11])[CH:6]=[CH:7][C:8]=1[CH3:9].[C:12](OCC)(=[O:17])[CH2:13][C:14]([CH3:16])=O.C([O-])(=O)C.[Na+].C(O)(=O)C>C(O)C>[CH3:2][C:3]1[CH:4]=[C:5]([N:10]2[C:12]([OH:17])=[CH:13][C:14]([CH3:16])=[N:11]2)[CH:6]=[CH:7][C:8]=1[CH3:9]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 176Acetic AcidHCID 8868Ethyl AcetoacetateHCID 517045Sodium AcetateHCID 43833382(3,4-Dimethylanilino)azanium chloride

생성물 1

HCID 178429255HCID 178429255, 화합물수율 71%

시약·촉매·용매 1

HCID 702Ethanol용매

실험 절차

2-(3,4-Dimethylphenyl)hydrazinium chloride (900 g, 5.21 mol), ethyl acetoacetate (678 g, 5.21 mol), sodium acetate (428 g, 5.21 mol) and glacial acetic acid (10 L) were stirred at 118° C. for about 24 hours. The resulting mixture was cooled and concentrated, and the residue was dissolved in dichloromethane (10 L) and carefully washed with saturated sodium bicarbonate (3×3 L). The organic layer was concentrated to afford a solid. The solid was dissolved in ethanol (450 mL) under reflux. Petroleum ether (7.2 L) was slowly added, and the resulting mixture was cooled and filtered to afford the title compound (748 g, 71%). PXRD analysis provided the diffractogram as shown in FIG. 31.

후처리

  1. temperatureThe resulting mixture was cooled
  2. concentrationconcentrated
  3. dissolutionthe residue was dissolved in dichloromethane (10 L)
  4. washcarefully washed with saturated sodium bicarbonate (3×3 L)
  5. concentrationThe organic layer was concentrated
  6. customto afford a solid
  7. temperatureunder reflux
  8. temperaturethe resulting mixture was cooled
  9. filtrationfiltered

출처 및 근거

ORD 기록
ord-5bac8ccf022244639af79565a4ffcf87
출처 데이터셋
uspto-grants-2011_09
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08022093B2

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