1,2-Dichloroethane → HCID 178456297, compound

HRID 676534Notes

Reaction equation

HRID 676534 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].[CH3:34][C:35](=[O:36])[OH:37].[CH3:52][OH:53].[CH:30]([CH2:31][CH3:32])=[O:33].[CH:54]([Cl:55])([Cl:56])[Cl:57].[Cl:58][CH2:59][CH2:60][Cl:61].[ClH:29].[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][NH:26][CH2:27][CH2:28]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][N:26]([CH2:30][CH2:31][CH3:32])[CH2:27][CH2:28]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

10

Reactant 9

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 527PropanalHCID 887MethanolHCID 923Sodium ionHCID 6212ChloroformHCID 2724942TriacetoxyborohydrideHCID 178527276HCID 178527276, compound

Product 1

HCID 178456297HCID 178456297, compound

Sources & evidence

ORD record
ord-e9930f37145d4cd8a830dbd7d0d0df83
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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