HRID126401

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID1068

Dimethyl sulfide

C2H6S

HCID6259

2-Bromoacetophenone

C8H7BrO

HCID6331

Borane

H3B

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

结构：CB1NC(C2CCCCC2)C(c2ccccc2)(c2ccccc2)O1

HCID10267927

未命名化合物

2 次

PRODUCTS

生成物

HCID102812

2-Bromo-1-phenylethan-1-ol

C8H9BrO

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ea3ef6a0be914e0bb59adf00faebe3d2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[BH3:28].[BH3:63].[Br:29][CH2:30][C:31](=[O:32])[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[CH3:25][S:26][CH3:27].[CH3:69][CH2:70][O:71][C:72](=[O:73])[CH3:74].[CH3:75][OH:76].[CH:1]1([CH:2]2[C:3]([c:4]3[cH:5][cH:6][cH:7][cH:8][cH:9]3)([c:10]3[cH:11][cH:12][cH:13][cH:14][cH:15]3)[O:16][B:17]([CH3:18])[NH:19]2)[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]1.[CH:39]1([CH:40]2[C:41]([c:42]3[cH:43][cH:44][cH:45][cH:46][cH:47]3)([c:48]3[cH:49][cH:50][cH:51][cH:52][cH:53]3)[O:54][B:55]([CH3:56])[NH:57]2)[CH2:58][CH2:59][CH2:60][CH2:61][CH2:62]1.[O:64]1[CH2:65][CH2:66][CH2:67][CH2:68]1>>[Br:29][CH2:30][CH:31]([OH:32])[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1