1,2-Dichloroethane → HCID 178456298, compound

HRID 314569Notes

Reaction equation

HRID 314569 reaction equation
[C:38]([O:39][BH-:40]([O:41][C:42](=[O:43])[CH3:44])[O:45][C:46](=[O:47])[CH3:48])(=[O:49])[CH3:50].[CH3:30][C:31]([CH3:32])=[O:33].[CH3:34][C:35](=[O:36])[OH:37].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[Cl:52][CH2:53][CH2:54][Cl:55].[Na+:51].[c:1]1([S:11](=[O:12])(=[O:13])[c:14]2[n:15][nH:16][c:17]3[cH:18][cH:19][c:20]([O:23][CH:24]4[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]4)[cH:21][c:22]23)[cH:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12>>[c:1]1([S:11](=[O:12])(=[O:13])[c:14]2[n:15][nH:16][c:17]3[cH:18][cH:19][c:20]([O:23][CH:24]4[CH2:25][CH2:26][N:27]([CH:31]([CH3:30])[CH3:32])[CH2:28][CH2:29]4)[cH:21][c:22]23)[cH:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 180AcetoneHCID 923Sodium ionHCID 8857Ethyl AcetateHCID 2724942TriacetoxyborohydrideHCID 178527277HCID 178527277, compound

Product 1

HCID 178456298HCID 178456298, compound

Sources & evidence

ORD record
ord-3c27e809966944268c22996a0019b970
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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