HRID87964

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID167232

Periodate ion

IO4-

结构：Oc1ccc2c(c1)CCCC(c1ccccc1)=C2c1ccc(OCCCCSCCCC(F)(F)C(F)(F)F)cc1

HCID21868921

5-[4-[4-(4,4,5,5,5-Pentafluoropentylsulfanyl)butoxy]phenyl]-6-phenyl-8,9-dihydro-7H-benzo[7]annulen-2-ol

C32H33F5O2S

PRODUCTS

生成物

结构：O=S(CCCCOc1ccc(C2=C(c3ccccc3)CCCc3cc(O)ccc32)cc1)CCCC(F)(F)C(F)(F)F

HCID21868924

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-569060754d11435792c2ecba9ac856ea
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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