HRID312277

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID13831

Tributylphosphine

C12H27P

HCID73042

1,1′-(1,2-Diazenediyl)bis[1-(1-piperidinyl)methanone]

C12H20N4O2

HCID57345855

Methyl (6-hydroxy-2,3-dihydro-1-benzofuran-3-yl)acetate

C11H12O4

结构：Cc1cc(OCCCS(C)(=O)=O)c(F)c(C)c1-c1cccc(CO)c1

HCID59342565

未命名化合物

PRODUCTS

生成物

结构：COC(=O)CC1COc2cc(OCc3cccc(-c4c(C)cc(OCCCS(C)(=O)=O)c(F)c4C)c3)ccc21

HCID72259613

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-66edcb5d01e24b3c8326860d034250c2
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

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