HRID1221952

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID75555

未命名化合物

HCID136187

2,2-Difluoroethanol

C2H4F2O

HCID178448751

未命名化合物

PRODUCTS

产物

反应SMILES：CC(C)(C)n1nc(C(F)(F)F)cc1OCC(F)F

HCID23075674

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-53074ea48b824539882c48cc6798c290
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:1]([CH3:2])([CH3:3])([CH3:4])[n:5]1[n:6][c:7]([C:11]([F:12])([F:13])[F:14])[cH:8][c:9]1[OH:10].[F:34][CH:35]([CH2:36][OH:37])[F:38].[O:39]=[C:40]([O:41][CH:42]([CH3:43])[CH3:44])[N:45]=[N:46][C:47]([O:48][CH:49]([CH3:50])[CH3:51])=[O:52].[O:53]1[CH2:54][CH2:55][CH2:56][CH2:57]1.[OH2:58].[c:15]1([P:16]([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[n:5]1[n:6][c:7]([C:11]([F:12])([F:13])[F:14])[cH:8][c:9]1[O:10][CH2:36][CH:35]([F:34])[F:38]