HRID98149

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID1061

Phosphate

O4P-3

HCID7360

Tetrahydrofurfuryl alcohol

C5H10O2

HCID31275

1,4-Dioxane

C4H8O2

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

结构：CC(Nc1nc(Cl)cc(Nc2cnccn2)n1)c1ccc(F)cc1

HCID178463434

未命名化合物

PRODUCTS

生成物

结构：CC(Nc1nc(Nc2cnccn2)cc(OCC2CCCO2)n1)c1ccc(F)cc1

HCID178463513

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ab97bf1a5e304daebb905fb5253f0c50
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

[CH2:67]([CH:68]1[CH2:69][CH2:70][CH2:71][O:72]1)[OH:73].[CH2:74]1[O:75][CH2:76][CH2:77][O:78][CH2:79]1.[CH:33]1([P:34]([CH:35]2[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][c:46]2-[c:47]2[c:48]([CH:49]([CH3:50])[CH3:51])[cH:52][c:53]([CH:54]([CH3:55])[CH3:56])[cH:57][c:58]2[CH:59]([CH3:60])[CH3:61])[CH2:62][CH2:63][CH2:64][CH2:65][CH2:66]1.[Cl:1][c:2]1[cH:3][c:4]([NH:18][c:19]2[n:20][cH:21][cH:22][n:23][cH:24]2)[n:5][c:6]([NH:8][CH:9]([CH3:10])[c:11]2[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]2)[n:7]1.[K+:30].[K+:31].[K+:32].[P:25]([O-:26])([O-:27])([O-:28])=[O:29]>>[c:2]1([O:73][CH2:67][CH:68]2[CH2:69][CH2:70][CH2:71][O:72]2)[cH:3][c:4]([NH:18][c:19]2[n:20][cH:21][cH:22][n:23][cH:24]2)[n:5][c:6]([NH:8][CH:9]([CH3:10])[c:11]2[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]2)[n:7]1