HRID150077

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID1049

Pyridine

C5H5N

HCID8103

1-Hexanol

C6H14O

HCID166653

Hydride

H-

结构：O=S(=O)(C(c1c(F)c(F)c(-c2c(F)c(F)c(F)c(F)c2F)c(F)c1F)S(=O)(=O)C(F)(F)F)C(F)(F)F

HCID21024168

(4-(Pentafluorophenyl)-2,3,5,6-tetrafluorophenyl}bis(triflyl)methane

C15HF15O4S2

PRODUCTS

生成物

结构：CCCCCCOc1c(F)c(F)c(-c2c(F)c(F)c(C(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F)c(F)c2F)c(F)c1F

HCID17858624

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c76252e9e10d4f298cf4c5c10e6d2d00
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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