HRID1208445

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID8028

Tetrahydrofuran

C4H8O

HCID136809

Benzophenone imine

C13H11N

结构：c1ccc(P(c2ccccc2)c2ccc3ccccc3c2-c2c(P(c3ccccc3)c3ccccc3)ccc3ccccc23)cc1

HCID634876

2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl

C44H32P2

HCID4574913

未命名化合物

HCID67442558

未命名化合物

PRODUCTS

生成物

HCID67443361

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f96ecbfbe95949c6b4d9113e07c44a7a
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:16]([c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)([c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)=[NH:29].[CH3:76][C:77]([CH3:78])([O-:79])[CH3:80].[CH3:88][c:89]1[cH:90][cH:91][cH:92][cH:93][cH:94]1.[Cl:1][C:2]1([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]2)[NH:3][CH:4]=[CH:5][CH:6]=[CH:7]1.[ClH:82].[Na+:81].[O:83]1[CH2:84][CH2:85][CH2:86][CH2:87]1.[c:30]1([P:31]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:38]2[cH:39][cH:40][c:41]3[c:42]([cH:43][cH:44][cH:45][cH:46]3)[c:47]2-[c:48]2[c:49]3[c:50]([cH:51][cH:52][cH:53][cH:54]3)[cH:55][cH:56][c:57]2[P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[cH:71][cH:72][cH:73][cH:74][cH:75]1>>[C:2]1([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]2)([NH2:29])[NH:3][CH:4]=[CH:5][CH:6]=[CH:7]1