Toluene → ethyl 6-chloro-7-(4-ethynyl-2-methylphenoxy)-2-(trifluoromethyl)-2H-chromene-3-carboxylate

HRID 309903

반응식

HRID 309903 반응식
[CH2:30]([CH2:31][CH2:43][CH3:44])[Sn:32]([CH2:33][CH2:34][CH2:35][CH3:36])([CH2:37][CH2:38][CH2:39][CH3:40])[C:41]#[CH:42].[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[Cl:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][c:11]1[O:12][c:13]1[c:14]([CH3:20])[cH:15][c:16]([I:19])[cH:17][cH:18]1)[O:8][CH:7]([C:21]([F:22])([F:23])[F:24])[C:6]([C:25](=[O:26])[O:27][CH2:28][CH3:29])=[CH:5]2>>[Cl:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][c:11]1[O:12][c:13]1[c:14]([CH3:20])[cH:15][c:16]([C:30]#[CH:31])[cH:17][cH:18]1)[O:8][CH:7]([C:21]([F:22])([F:23])[F:24])[C:6]([C:25](=[O:26])[O:27][CH2:28][CH3:29])=[CH:5]2

참가 물질

4

반응물 3

HCID 1140TolueneHCID 621176EthynyltributyltinHCID 58935024ethyl 6-chloro-7-(2-methyl-4-iodophenoxy)-2-(trifluoromethyl)-2H-chromene-3-carboxylate

생성물 1

HCID 86599479ethyl 6-chloro-7-(4-ethynyl-2-methylphenoxy)-2-(trifluoromethyl)-2H-chromene-3-carboxylate

출처 및 근거

ORD 기록
ord-d24d1d678a964267b3f4efbb42c54ef9
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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