HRID834545

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID813

Potassium cation

K+

3 次

HCID962

Water

H2O

HCID1061

Phosphate

O4P-3

HCID1140

Toluene

C7H8

HCID105144

Palladium(2+)

Pd+2

结构：COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1

HCID11269872

2-Dicyclohexylphosphino-2′,6′-dimethoxybiphenyl

C26H35O2P

HCID57443493

Methyl (4-chloro-2-fluorophenyl)acetate

C9H8ClFO2

结构：CCC(O)(C=Cc1ccc(C(CC)(CC)c2cc(C)c(B3OC(C)(C)C(C)(C)O3)c(C)c2)cc1C)CC

HCID67065087

未命名化合物

PRODUCTS

生成物

结构：CCC(O)(C=Cc1ccc(C(CC)(CC)c2cc(C)c(-c3ccc(CC(=O)OC)c(F)c3)c(C)c2)cc1C)CC

HCID67065104

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1ef3f7573b8447b495c621fd604af07e
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:102]([O-:103])(=[O:104])[CH3:105].[C:97]([O-:98])(=[O:99])[CH3:100].[CH3:1][O:2][C:3]([CH2:4][c:5]1[c:6]([F:12])[cH:7][c:8]([Cl:11])[cH:9][cH:10]1)=[O:13].[CH3:51][c:52]1[cH:53][c:54]([C:68]([CH2:69][CH3:70])([CH2:71][CH3:72])[c:73]2[cH:74][c:75]([CH3:87])[c:76]([CH:79]=[CH:80][C:81]([CH2:82][CH3:83])([OH:84])[CH2:85][CH3:86])[cH:77][cH:78]2)[cH:55][c:56]([CH3:67])[c:57]1[B:58]1[O:59][C:60]([CH3:61])([CH3:62])[C:63]([CH3:64])([CH3:65])[O:66]1.[CH3:90][c:91]1[cH:92][cH:93][cH:94][cH:95][cH:96]1.[CH:14]1([P:15]([CH:16]2[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2)[c:22]2[cH:23][cH:24][cH:25][cH:26][c:27]2-[c:28]2[c:29]([O:30][CH3:31])[cH:32][cH:33][cH:34][c:35]2[O:36][CH3:37])[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42]1.[Cl-:88].[K+:48].[K+:49].[K+:50].[NH4+:89].[OH2:106].[P:43]([O-:44])([O-:45])([O-:46])=[O:47].[Pd+2:101]>>[CH3:1][O:2][C:3]([CH2:4][c:5]1[c:6]([F:12])[cH:7][c:8](-[c:57]2[c:52]([CH3:51])[cH:53][c:54]([C:68]([CH2:69][CH3:70])([CH2:71][CH3:72])[c:73]3[cH:74][c:75]([CH3:87])[c:76]([CH:79]=[CH:80][C:81]([CH2:82][CH3:83])([OH:84])[CH2:85][CH3:86])[cH:77][cH:78]3)[cH:55][c:56]2[CH3:67])[cH:9][cH:10]1)=[O:13]