HRID1537056

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8071

未命名化合物

HCID11776

Triphenylphosphine

C18H15P

3 次

HCID24290

未命名化合物

HCID28123

Tetrahydroborate

H4B-

HCID70693

Acetic acid, cyano-, 1,1-dimethylethyl ester

C7H11NO2

HCID2776578

5-Bromo-1-benzothiophene

C8H5BrS

HCID4574913

未命名化合物

PRODUCTS

生成物

HCID58239409

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-13d57469c0104eafbd53808149c881a6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[BH4-:20].[Br:38][c:39]1[cH:40][cH:41][c:42]2[c:43]([cH:44][cH:45][s:46]2)[cH:47]1.[C:28](#[N:29])[CH2:30][C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37].[CH3:22][C:23]([CH3:24])([O-:25])[CH3:26].[CH3:91][O:92][CH2:93][CH2:94][O:95][CH3:96].[ClH:48].[K+:27].[Na+:21].[OH2:90].[Pd:49]([Cl:50])[Cl:51].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1.[c:52]1([P:53]([c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)[cH:66][cH:67][cH:68][cH:69][cH:70]1.[c:71]1([P:72]([c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)[cH:85][cH:86][cH:87][cH:88][cH:89]1>>[C:28](#[N:29])[CH:30]([C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[c:39]1[cH:40][cH:41][c:42]2[c:43]([cH:44][cH:45][s:46]2)[cH:47]1