HRID671703

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID9321

Hydrazine

H4N2

结构：Fc1cc(OC(F)(F)c2c(F)cc(Br)cc2F)cc(F)c1C(F)(F)F

HCID58444567

未命名化合物

HCID58444591

未命名化合物

PRODUCTS

生成物

结构：CCC1CCC(c2ccc(-c3cc(F)c(C(F)(F)Oc4cc(F)c(C(F)(F)F)c(F)c4)c(F)c3)c(F)c2)CC1

HCID58444585

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4236cfc91708438ebf7d442501d4f328
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

[Br:4][c:5]1[cH:6][c:7]([F:28])[c:8]([C:12]([O:13][c:14]2[cH:15][c:16]([F:25])[c:17]([C:21]([F:22])([F:23])[F:24])[c:18]([F:20])[cH:19]2)([F:26])[F:27])[c:9]([F:11])[cH:10]1.[CH2:29]([CH3:30])[CH:31]1[CH2:32][CH2:33][CH:34]([c:37]2[cH:38][c:39]([F:46])[c:40]([B:43]([OH:44])[OH:45])[cH:41][cH:42]2)[CH2:35][CH2:36]1.[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[NH2:2][NH2:3].[OH-:1].[OH2:47]>>[c:5]1(-[c:40]2[c:39]([F:46])[cH:38][c:37]([CH:34]3[CH2:33][CH2:32][CH:31]([CH2:29][CH3:30])[CH2:36][CH2:35]3)[cH:42][cH:41]2)[cH:6][c:7]([F:28])[c:8]([C:12]([O:13][c:14]2[cH:15][c:16]([F:25])[c:17]([C:21]([F:22])([F:23])[F:24])[c:18]([F:20])[cH:19]2)([F:26])[F:27])[c:9]([F:11])[cH:10]1