HRID1140994

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7204

2-(4-Chloro-2-methylphenoxy)acetic acid

C9H9ClO3

结构：CCCCOC(=O)C(C)Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1

HCID50897

Fluazifop-butyl

C19H20F3NO4

结构：CCOC(=O)C(C)Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1

HCID53518

Quizalofop-ethyl

C19H17ClN2O4

PRODUCTS

生成物

HCID1486

2,4-Dichlorophenoxyacetic acid

C8H6Cl2O3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d527c1c18f034333ba0ac225bdf66618
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:1][c:2]1[c:3]([O:4][CH2:5][C:6](=[O:7])[OH:8])[cH:9][cH:10][c:11]([Cl:13])[cH:12]1.[Cl:41][c:42]1[cH:43][c:44]2[c:45]([cH:46][cH:47]1)[n:48][c:49]([O:50][c:51]1[cH:52][cH:53][c:54]([O:55][CH:56]([CH3:57])[C:58]([O:59][CH2:60][CH3:61])=[O:62])[cH:63][cH:64]1)[cH:65][n:66]2.[F:14][C:15]([F:16])([F:17])[c:18]1[cH:19][cH:20][c:21]([O:22][c:23]2[cH:24][cH:25][c:26]([O:27][CH:28]([CH3:29])[C:30]([O:31][CH2:32][CH2:33][CH2:34][CH3:35])=[O:36])[cH:37][cH:38]2)[n:39][cH:40]1>>[c:2]1([Cl:41])[c:3]([O:4][CH2:5][C:6](=[O:7])[OH:8])[cH:9][cH:10][c:11]([Cl:13])[cH:12]1