HRID1144028

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID962

Water

H2O

HCID1061

Phosphate

O4P-3

HCID31275

1,4-Dioxane

C4H8O2

结构：CC(C)(C)OC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1

HCID4642098

tert-Butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydropyridine-1(2H)-carboxylate

C16H28BNO4

结构：C[Si](C)(C)CCOCN(COCC[Si](C)(C)C)c1cc(Cl)nc2c(-c3cnc4ccccc4c3)cnn12

HCID86664780

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CC=C(c2cc(N(COCC[Si](C)(C)C)COCC[Si](C)(C)C)n3ncc(-c4cnc5ccccc5c4)c3n2)CC1

HCID67494206

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4f496736eeb54e0a8d8bc5167feca079
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH2:68]1[O:69][CH2:70][CH2:71][O:72][CH2:73]1.[CH3:38][C:39]1([CH3:40])[C:41]([CH3:42])([CH3:43])[O:44][B:45]([C:46]2=[CH:47][CH2:48][N:49]([C:52](=[O:53])[O:54][C:55]([CH3:56])([CH3:57])[CH3:58])[CH2:50][CH2:51]2)[O:59]1.[Cl:1][c:2]1[n:3][c:4]2[n:5]([c:6]([N:8]([CH2:9][O:10][CH2:11][CH2:12][Si:13]([CH3:14])([CH3:15])[CH3:16])[CH2:17][O:18][CH2:19][CH2:20][Si:21]([CH3:22])([CH3:23])[CH3:24])[cH:7]1)[n:25][cH:26][c:27]2-[c:28]1[cH:29][n:30][c:31]2[cH:32][cH:33][cH:34][cH:35][c:36]2[cH:37]1.[K+:65].[K+:66].[K+:67].[OH2:74].[P:60]([O-:61])([O-:62])([O-:63])=[O:64]>>[c:2]1([C:46]2=[CH:47][CH2:48][N:49]([C:52](=[O:53])[O:54][C:55]([CH3:56])([CH3:57])[CH3:58])[CH2:50][CH2:51]2)[n:3][c:4]2[n:5]([c:6]([N:8]([CH2:9][O:10][CH2:11][CH2:12][Si:13]([CH3:14])([CH3:15])[CH3:16])[CH2:17][O:18][CH2:19][CH2:20][Si:21]([CH3:22])([CH3:23])[CH3:24])[cH:7]1)[n:25][cH:26][c:27]2-[c:28]1[cH:29][n:30][c:31]2[cH:32][cH:33][cH:34][cH:35][c:36]2[cH:37]1