1,2-Dichloroethane → HCID 68497728, compound

HRID 2131098Notes

Reaction equation

HRID 2131098 reaction equation
[C:37]([O:38][BH-:39]([O:40][C:41](=[O:42])[CH3:43])[O:44][C:45](=[O:46])[CH3:47])(=[O:48])[CH3:49].[CH3:1][n:2]1[c:3]([C:21](=[O:22])[N:23]2[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]2)[cH:4][c:5]2[cH:6][c:7]([O:11][c:12]3[n:13][cH:14][c:15]([N+:18](=[O:19])[O-:20])[cH:16][cH:17]3)[cH:8][cH:9][c:10]12.[CH3:51][C:52](=[O:53])[OH:54].[CH:29](=[O:30])[c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[Cl:55][CH2:56][CH2:57][Cl:58].[Na+:50]>>[CH3:1][n:2]1[c:3]([C:21](=[O:22])[N:23]2[CH2:24][CH2:25][N:26]([CH2:29][c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[CH2:27][CH2:28]2)[cH:4][c:5]2[cH:6][c:7]([O:11][c:12]3[n:13][cH:14][c:15]([N+:18](=[O:19])[O-:20])[cH:16][cH:17]3)[cH:8][cH:9][c:10]12

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 240BenzaldehydeHCID 923Sodium ionHCID 2724942TriacetoxyborohydrideHCID 68494257HCID 68494257, compound

Product 1

HCID 68497728HCID 68497728, compound

Sources & evidence

ORD record
ord-8fec1caaf68147909a5d48cc6fe9cd54
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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