HRID290561

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9086

3-Aminopropanol

C3H9NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID67030

9,10-Anthraquinone 2-carboxylic acid

C15H8O4

结构：CN(C)[P+](On1nnc2ccccc21)(N(C)C)N(C)C

HCID124335

Benzotriazol-1-yloxy-tris(dimethylamino)phosphonium

C12H22N6OP+

PRODUCTS

生成物

结构：O=C(NCCCO)c1ccc2c(c1)C(=O)c1ccccc1C2=O

HCID18624454

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4e2bbf9f9dc243a1bd794d467eaffd75
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

[NH2:47][CH2:48][CH2:49][CH2:50][OH:51].[O:53]=[CH:54][N:55]([CH3:56])[CH3:57].[OH2:52].[P-:20]([F:21])([F:22])([F:23])([F:24])([F:25])[F:26].[cH:1]1[c:2]([C:17](=[O:18])[OH:19])[cH:3][cH:4][c:5]2[c:14]1[C:13](=[O:15])[c:12]1[c:7]([cH:8][cH:9][cH:10][cH:11]1)[C:6]2=[O:16].[n:27]1([O:28][P+:29]([N:30]([CH3:31])[CH3:32])([N:33]([CH3:34])[CH3:35])[N:36]([CH3:37])[CH3:38])[c:39]2[cH:40][cH:41][cH:42][cH:43][c:44]2[n:45][n:46]1>>[cH:1]1[c:2]([C:17](=[O:19])[NH:47][CH2:48][CH2:49][CH2:50][OH:51])[cH:3][cH:4][c:5]2[c:14]1[C:13](=[O:15])[c:12]1[c:7]([cH:8][cH:9][cH:10][cH:11]1)[C:6]2=[O:16]