HRID678338

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID3028194

Lithium

结构：CC12CCC3c4ccc(OC5CCCCO5)cc4CCC3C1CCC2=O

HCID15618135

未命名化合物

HCID15635908

(Difluoromethyl)(oxo)diphenyl-lambda~5~-phosphane

C13H11F2OP

PRODUCTS

生成物

结构：CC12CCC3c4ccc(OC5CCCCO5)cc4CCC3C1CCC2=C(F)F

HCID178420974

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-441de06f2dc742c3aa2bf6145799e7f8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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