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Methanol → 5-[3,5-Bis(1,1-dimethyl-ethyl)-4-hydroxyphenyl]-1,3,4-thiadiazole-2-yl[thio]acetic acid

HRID 2348549
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반응식

HRID 2348549 반응식
[Br:24][CH2:25][C:26](=[O:27])[OH:28].[CH3:29][OH:30].[CH3:3][C:4]([CH3:5])([CH3:6])[c:7]1[cH:8][c:9](-[c:18]2[n:19][nH:20][c:21](=[S:23])[s:22]2)[cH:10][c:11]([C:14]([CH3:15])([CH3:16])[CH3:17])[c:12]1[OH:13].[Na+:2].[OH-:1]>>[CH3:3][C:4]([CH3:5])([CH3:6])[c:7]1[cH:8][c:9](-[c:18]2[n:19][n:20][c:21]([S:23][CH2:25][C:26](=[O:27])[OH:28])[s:22]2)[cH:10][c:11]([C:14]([CH3:15])([CH3:16])[CH3:17])[c:12]1[OH:13]
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참가 물질

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반응물 5

HCID 887MethanolHCID 923Sodium IonHCID 961HydroxideHCID 6227Bromoacetic AcidHCID 30370185-(3,5-Di-tert-butyl-4-hydroxyphenyl)-1,3,4-thiadiazole-2(3H)-thione

생성물 1

HCID 1360083465-[3,5-Bis(1,1-dimethyl-ethyl)-4-hydroxyphenyl]-1,3,4-thiadiazole-2-yl[thio]acetic acid

출처 및 근거

ORD 기록
ord-b148ddb6236642afa3a6d141e77c8b79
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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