HRID165089

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID7972

4-Methylmorpholine

C5H11NO

HCID73910

Diphenylphosphinic chloride

C12H10ClOP

结构：c1ccc(P(CC2CC(P(c3ccccc3)c3ccccc3)CN2)c2ccccc2)cc1

HCID5000071

未命名化合物

PRODUCTS

生成物

结构：O=P(c1ccccc1)(c1ccccc1)N1CC(P(c2ccccc2)c2ccccc2)CC1CP(c1ccccc1)c1ccccc1

HCID19881686

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e2035c737b11446dbbd994075381f4e1
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

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