HRID1134162

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID3283

Diethyl Ether

C4H10O

HCID8028

Tetrahydrofuran

C4H8O

结构：O=C(OCc1ccccc1)c1cc(OCc2ccccc2)c(Br)c(OCc2ccccc2)c1

HCID10051813

Benzyl 3,5-bis(benzyloxy)-4-bromobenzoate

C28H23BrO4

PRODUCTS

生成物

结构：O=C(O)c1cc(OCc2ccccc2)c(Br)c(OCc2ccccc2)c1

HCID10024710

3,5-Bis(benzyloxy)-4-bromobenzoic acid

C21H17BrO4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0e39d0a2fc1044599a1529ae4f5c5c4b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([c:10]1[cH:11][c:12]([O:25][CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:13]([Br:24])[c:14]([O:16][CH2:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:15]1)=[O:33].[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:36][CH2:37][O:38][CH2:39][CH3:40].[Na+:35].[OH-:34].[OH2:46]>>[O:8]=[C:9]([c:10]1[cH:11][c:12]([O:25][CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:13]([Br:24])[c:14]([O:16][CH2:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:15]1)[OH:33]