HRID143638

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11776

Triphenylphosphine

C18H15P

HCID67985

1,3-Difluoro-2-propanol

C3H6F2O

结构：O=C(c1cc([N+](=O)[O-])ccc1O)N1CCN(c2ccc(C(F)(F)F)cc2)CC1

HCID69036826

未命名化合物

PRODUCTS

生成物

结构：O=C(c1cc([N+](=O)[O-])ccc1OC(CF)CF)N1CCN(c2ccc(C(F)(F)F)cc2)CC1

HCID69038209

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-19309a4d186a48e79b85f3aca2d8f3b7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[F:29][CH2:30][CH:31]([CH2:32][F:33])[OH:34].[OH:1][c:2]1[c:3]([C:11](=[O:12])[N:13]2[CH2:14][CH2:15][N:16]([c:19]3[cH:20][cH:21][c:22]([C:25]([F:26])([F:27])[F:28])[cH:23][cH:24]3)[CH2:17][CH2:18]2)[cH:4][c:5]([N+:8](=[O:9])[O-:10])[cH:6][cH:7]1.[c:35]1([P:36]([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[cH:49][cH:50][cH:51][cH:52][cH:53]1>>[O:1]([c:2]1[c:3]([C:11](=[O:12])[N:13]2[CH2:14][CH2:15][N:16]([c:19]3[cH:20][cH:21][c:22]([C:25]([F:26])([F:27])[F:28])[cH:23][cH:24]3)[CH2:17][CH2:18]2)[cH:4][c:5]([N+:8](=[O:9])[O-:10])[cH:6][cH:7]1)[CH:31]([CH2:30][F:29])[CH2:32][F:33]