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Acetate → Ethyl 3-[4-[cyclohexylidene-(4-hydroxy-2-methylphenyl)methyl]phenyl]prop-2-enoate

HRID 2317806
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HRID 2317806 반응식
[Br:1][c:2]1[cH:3][cH:4][c:5]([C:8]([c:9]2[c:10]([CH3:16])[cH:11][c:12]([OH:15])[cH:13][cH:14]2)=[C:17]2[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]2)[cH:6][cH:7]1.[C:23]([CH:24]=[CH2:25])(=[O:26])[O:27][CH2:28][CH3:29].[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[O-:44][C:45]([CH3:46])=[O:47].[O-:48][C:49]([CH3:50])=[O:51].[O:38]=[CH:39][N:40]([CH3:41])[CH3:42].[OH2:37].[Pd+2:43]>>[c:2]1([CH:25]=[CH:24][C:23](=[O:26])[O:27][CH2:28][CH3:29])[cH:3][cH:4][c:5]([C:8]([c:9]2[c:10]([CH3:16])[cH:11][c:12]([OH:15])[cH:13][cH:14]2)=[C:17]2[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]2)[cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 175Acetate2회HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 8821Ethyl AcrylateHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 686545414-[(4-Bromophenyl)(cyclohexylidene)methyl]-3-methylphenol

생성물 1

HCID 68976301Ethyl 3-[4-[cyclohexylidene-(4-hydroxy-2-methylphenyl)methyl]phenyl]prop-2-enoate

출처 및 근거

ORD 기록
ord-35d3020098994be8835bf86a5d4c44e1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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