Acetic Acid → 3-(4-Formyl-benzooxazol-2-yl)-benzoic acid methyl ester

반응식

[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6](-[c:10]2[o:11][c:12]3[c:13]([n:14]2)[c:15]([CH2:19][Br:20])[cH:16][cH:17][cH:18]3)[cH:7][cH:8][cH:9]1)=[O:21].[CH3:22][C:23]([OH:24])=[O:25].[OH2:26]>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6](-[c:10]2[o:11][c:12]3[c:13]([n:14]2)[c:15]([CH:19]=[O:24])[cH:16][cH:17][cH:18]3)[cH:7][cH:8][cH:9]1)=[O:21]

참가 물질

반응물 3

HCID 176Acetic Acid

HCID 962Water

HCID 672793503-(4-Bromomethyl-benzooxazol-2-yl)-benzoic acid methyl ester

생성물 1

HCID 860661063-(4-Formyl-benzooxazol-2-yl)-benzoic acid methyl ester

출처 및 근거

ORD 기록: ord-5392ee65672a4572a61c1d675db499ff
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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