Isopropanol → Propan-2-yl 1-oxo-1,3-dihydro-2-benzofuran-5-carboxylate

HRID 144590

반응식

[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[C:11](=[O:12])[O:10][CH2:9]2.[CH3:16][CH:17]([OH:18])[CH3:19]>>[CH:1]([CH3:2])([O:3][C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[C:11](=[O:12])[O:10][CH2:9]2)[CH3:16]

참가 물질

반응물 2

HCID 3776Isopropanol

HCID 90088Ethyl 1,3-dihydro-1-oxoisobenzofuran-5-carboxylate

생성물 1

HCID 21999398Propan-2-yl 1-oxo-1,3-dihydro-2-benzofuran-5-carboxylate

출처 및 근거

ORD 기록: ord-80367587ed7947259ceb6dc8d88622d3
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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