HRID1216841

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID7672

Phenyl isocyanate

C7H5NO

HCID8900

Heptane

C7H16

HCID9543249

Dibutyltin ion

C8H18Sn+2

HCID11816876

11-Dodecen-1-ol, 12,12-difluoro-

C12H22F2O

PRODUCTS

生成物

HCID19915371

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-305914b7c52742abb11ba63f8b09c791
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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