HRID319792

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID21885

2-Dimethylaminopyridine

C7H10N2

HCID21960626

未命名化合物

结构：CCCCCCCCOc1ccc(C(=O)Oc2ccc3c(c2)C(C)c2cc(O)ccc2-3)cc1

HCID58586937

7-Hydroxy-9-methyl-9H-fluoren-2-yl 4-(octyloxy)benzoate

C29H32O4

PRODUCTS

生成物

结构：C=CCOCCCCOc1ccc(C(=O)Oc2ccc3c(c2)C(C)c2cc(OC(=O)c4ccc(OCCCCCCCC)cc4)ccc2-3)cc1

HCID58586870

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d3ac225f38b841878c5d90c31c389ccd
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

[CH2:11]([N:12]=[C:13]=[N:14][CH2:15][CH2:16][CH2:17][N:18]([CH3:19])[CH3:20])[CH3:21].[CH2:22]([CH:23]=[CH2:24])[O:25][CH2:26][CH2:27][CH2:28][CH2:29][O:30][c:31]1[cH:32][cH:33][c:34]([C:35](=[O:36])[OH:37])[cH:38][cH:39]1.[CH2:40]([CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH3:47])[O:48][c:49]1[cH:50][cH:51][c:52]([C:53](=[O:54])[O:55][c:56]2[cH:57][c:58]3[c:66]([cH:67][cH:68]2)-[c:65]2[c:60]([cH:61][c:62]([OH:69])[cH:63][cH:64]2)[CH:59]3[CH3:70])[cH:71][cH:72]1.[CH2:74]([Cl:75])[Cl:76].[CH3:1][N:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][n:8]1)[CH3:9].[ClH:10].[OH2:73]>>[CH2:22]([CH:23]=[CH2:24])[O:25][CH2:26][CH2:27][CH2:28][CH2:29][O:30][c:31]1[cH:32][cH:33][c:34]([C:35](=[O:36])[O:37][c:62]2[cH:61][c:60]3[c:65]([cH:64][cH:63]2)-[c:66]2[c:58]([cH:57][c:56]([O:55][C:53]([c:52]4[cH:51][cH:50][c:49]([O:48][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH3:47])[cH:72][cH:71]4)=[O:54])[cH:68][cH:67]2)[CH:59]3[CH3:70])[cH:38][cH:39]1