HRID95289

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8083

Morpholine

C4H9NO

HCID9886

Hexafluorophosphate ion

F6P-

结构：CN(C)[P+](On1nnc2ccccc21)(N(C)C)N(C)C

HCID124335

Benzotriazol-1-yloxy-tris(dimethylamino)phosphonium

C12H22N6OP+

结构：COc1cc(OC(F)(F)F)ccc1-c1nc(OC)c(-n2cncc2C(=O)O)cc1C

HCID22490071

未命名化合物

PRODUCTS

生成物

结构：COc1cc(OC(F)(F)F)ccc1-c1nc(OC)c(-n2cncc2C(=O)N2CCOCC2)cc1C

HCID22490048

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-728a2061bb8a4d8b829f00334711698e
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

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