HRID824047

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID813

Potassium cation

K+

2 次

HCID1727

4-Aminopyridine

C5H6N2

HCID6386

tert-Butyl alcohol

C4H10O

HCID19660

Carbonate

CO3-2

HCID105144

Palladium(2+)

Pd+2

结构：CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1

HCID11155794

2-Dicyclohexylphosphino-2',4',6'-triisoprophylbiphenyl

C33H49P

HCID56924368

Methyl 2-chloro-1,3-benzoxazole-4-carboxylate

C9H6ClNO3

PRODUCTS

生成物

HCID66873583

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-28e0920df96144f3bb0382eefe21787c
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:71]([OH:72])([CH3:73])([CH3:74])[CH3:75].[CH:22]1([P:23]([CH:24]2[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]2)[c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]2-[c:36]2[c:37]([CH:38]([CH3:39])[CH3:40])[cH:41][c:42]([CH:43]([CH3:44])[CH3:45])[cH:46][c:47]2[CH:48]([CH3:49])[CH3:50])[CH2:51][CH2:52][CH2:53][CH2:54][CH2:55]1.[Cl:1][c:2]1[o:3][c:4]2[c:5]([n:6]1)[c:7]([C:11](=[O:12])[O:13][CH3:14])[cH:8][cH:9][cH:10]2.[K+:56].[K+:57].[NH2:15][c:16]1[cH:17][cH:18][n:19][cH:20][cH:21]1.[O-:58][C:59]([O-:60])=[O:61].[O-:63][C:64]([CH3:65])=[O:66].[O-:67][C:68]([CH3:69])=[O:70].[Pd+2:62]>>[c:2]1([NH:15][c:16]2[cH:17][cH:18][n:19][cH:20][cH:21]2)[o:3][c:4]2[c:5]([n:6]1)[c:7]([C:11](=[O:12])[O:13][CH3:14])[cH:8][cH:9][cH:10]2