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Hydrochloric Acid → 3-[4-({4-[(3,5-di-tert-butyl-1H-pyrazol-1-yl)methyl]benzyl}oxy)-2-fluorophenyl]propanoic acid

HRID 672269
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HRID 672269 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7]([CH2:14][c:15]2[cH:16][cH:17][c:18]([CH2:19][O:20][c:21]3[cH:22][c:23]([F:34])[c:24]([CH2:27][CH2:28][C:29](=[O:30])[O:31][CH2:32][CH3:33])[cH:25][cH:26]3)[cH:35][cH:36]2)[c:8]([C:10]([CH3:11])([CH3:12])[CH3:13])[cH:9]1.[CH3:45][OH:46].[ClH:44].[Na+:38].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH-:37]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7]([CH2:14][c:15]2[cH:16][cH:17][c:18]([CH2:19][O:20][c:21]3[cH:22][c:23]([F:34])[c:24]([CH2:27][CH2:28][C:29](=[O:30])[OH:31])[cH:25][cH:26]3)[cH:35][cH:36]2)[c:8]([C:10]([CH3:11])([CH3:12])[CH3:13])[cH:9]1
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반응물 6

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium IonHCID 961HydroxideHCID 8028TetrahydrofuranHCID 23159844ethyl 3-[4-({4-[(3,5-di-tert-butyl-1H-pyrazol-1-yl)methyl]benzyl}oxy)-2-fluorophenyl]propanoate

생성물 1

HCID 23159993
3-[4-({4-[(3,5-di-tert-butyl-1H-pyrazol-1-yl)methyl]benzyl}oxy)-2-fluorophenyl]propanoic acid

출처 및 근거

ORD 기록
ord-310e52f3970a4e28be47686783a4fbff
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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