HRID1219346

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

HCID223

Ammonia ion (NH4+)

H4N+

HCID813

Potassium cation

K+

HCID8028

Tetrahydrofuran

C4H8O

HCID16028

Tetrabutylammonium

C16H36N+

HCID30165

Iodide ion

I-

HCID4574913

未命名化合物

结构：CC(C)(C)OP(=O)(OC(C)(C)C)C(F)(F)c1ccc(CBr)cc1

HCID15922636

未命名化合物

结构：COC(=O)c1ccc(C(CC=Cc2ccccc2)C(=O)c2ccc(F)cc2)cc1

HCID70010353

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(C(CC=Cc2ccccc2)(Cc2ccc(C(F)(F)P(=O)(OC(C)(C)C)OC(C)(C)C)cc2)C(=O)c2ccc(F)cc2)cc1

HCID90997319

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4f35846a5efa4ba0aec77efc5af65598
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

[Br:36][CH2:37][c:38]1[cH:39][cH:40][c:41]([C:44]([F:45])([F:46])[P:47]([O:48][C:49]([CH3:50])([CH3:51])[CH3:52])([O:53][C:54]([CH3:55])([CH3:56])[CH3:57])=[O:58])[cH:42][cH:43]1.[CH2:65]([N+:66]([CH2:67][CH2:68][CH2:69][CH3:70])([CH2:71][CH2:72][CH2:73][CH3:74])[CH2:75][CH2:76][CH2:77][CH3:78])[CH2:79][CH2:80][CH3:81].[CH2:82]1[O:83][CH2:84][CH2:85][CH2:86]1.[CH3:30][C:31]([CH3:32])([O-:33])[CH3:34].[CH3:60][C:61](=[O:62])[O-:63].[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[CH:8]([CH2:9][CH:10]=[CH:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[c:18]2[cH:19][cH:20][c:21]([C:22](=[O:23])[O:24][CH3:25])[cH:26][cH:27]2)[cH:28][cH:29]1.[I-:64].[K+:35].[NH4+:59]>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[C:8]([CH2:9][CH:10]=[CH:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)([c:18]2[cH:19][cH:20][c:21]([C:22](=[O:23])[O:24][CH3:25])[cH:26][cH:27]2)[CH2:37][c:38]2[cH:39][cH:40][c:41]([C:44]([F:45])([F:46])[P:47]([O:48][C:49]([CH3:50])([CH3:51])[CH3:52])([O:53][C:54]([CH3:55])([CH3:56])[CH3:57])=[O:58])[cH:42][cH:43]2)[cH:28][cH:29]1