HRID146816

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID74648

3-Methylbenzeneethanol

C9H12O

HCID75555

未命名化合物

HCID6425184

methyl 4-bromo-3-hydroxybenzoate

C8H7BrO3

PRODUCTS

生成物

HCID67076565

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-93e4f536d0c94ef6b1b7199461720c1d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:56]1[O:57][CH2:58][CH2:59][CH2:60]1.[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([OH:11])[c:7]([Br:10])[cH:8][cH:9]1)=[O:12].[CH3:32][c:33]1[cH:34][c:35]([CH2:39][CH2:40][OH:41])[cH:36][cH:37][cH:38]1.[O:42]=[C:43]([O:44][CH:45]([CH3:46])[CH3:47])[N:48]=[N:49][C:50]([O:51][CH:52]([CH3:53])[CH3:54])=[O:55].[c:13]1([P:14]([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([O:11][CH2:40][CH2:39][c:35]2[cH:34][c:33]([CH3:32])[cH:38][cH:37][cH:36]2)[c:7]([Br:10])[cH:8][cH:9]1)=[O:12]