1,2-Dichloroethane → HCID 44595095, compound

HRID 1127685Notes

Reaction equation

HRID 1127685 reaction equation
[C:37](=[O:38])([OH:39])[O-:40].[C:5]([O:6][CH:9]([CH:10]1[C:11]([F:13])([F:14])[CH2:12]1)[c:15]1[c:16]([Cl:22])[cH:17][c:18]([Cl:21])[cH:19][cH:20]1)(=[O:7])[CH3:8].[CH3:23][S:24](=[O:25])(=[O:26])[CH2:27][c:28]1[cH:29][cH:30][cH:31][c:32]2[cH:33][cH:34][nH:35][c:36]12.[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[Cl-:1].[Cl-:3].[Cl-:4].[Cl:42][CH2:43][CH2:44][Cl:45].[In+3:2].[Na+:41]>>[CH:9]([CH:10]1[C:11]([F:13])([F:14])[CH2:12]1)([c:15]1[c:16]([Cl:22])[cH:17][c:18]([Cl:21])[cH:19][cH:20]1)[c:33]1[c:32]2[cH:31][cH:30][cH:29][c:28]([CH2:27][S:24]([CH3:23])(=[O:25])=[O:26])[c:36]2[nH:35][cH:34]1

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 312Chloride3×HCID 769Bicarbonate IonHCID 923Sodium ionHCID 8857Ethyl AcetateHCID 105148Indium cationHCID 58392161HCID 58392161, compoundHCID 583922947-[(Methylsulfonyl)methyl]-1H-indole

Product 1

HCID 44595095HCID 44595095, compound

Sources & evidence

ORD record
ord-50c32d6870ff462797a172eb6947b3b9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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