HRID300070

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID4455752

[Bis(dimethylamino)methylidene]chloranium

C5H12ClN2+

HCID59356651

未命名化合物

HCID178448811

未命名化合物

PRODUCTS

产物

HCID178494922

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-1438a2a578c64e5fabe869728d23735b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应SMILES

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