HRID671780

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID10433

Cyclohexane-1,3-diol

C6H12O2

HCID28179

Fluoride

F-

HCID61221

Dibutylstannane oxide

C8H18OSn

HCID104967

Cesium(1+)

Cs+

HCID10263795

未命名化合物

PRODUCTS

生成物

HCID21980299

Methyl 2-(3-hydroxycyclohexyloxymethyl)-6-methylbenzoate

C16H22O4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ec1d41d541864df4ab9374280c8426e3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br:19][CH2:20][c:21]1[c:22]([C:23](=[O:24])[O:25][CH3:26])[c:27]([CH3:31])[cH:28][cH:29][cH:30]1.[CH2:9]([Sn:10](=[O:11])[CH2:12][CH2:13][CH2:14][CH3:15])[CH2:16][CH2:17][CH3:18].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[CH:1]1([OH:8])[CH2:2][CH:3]([OH:7])[CH2:4][CH2:5][CH2:6]1.[Cs+:33].[F-:32].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[OH2:41]>>[CH:1]1([O:8][CH2:20][c:21]2[c:22]([C:23](=[O:24])[O:25][CH3:26])[c:27]([CH3:31])[cH:28][cH:29][cH:30]2)[CH2:2][CH:3]([OH:7])[CH2:4][CH2:5][CH2:6]1