1,2-Dichloroethane → HCID 59587376, compound

HRID 671858Notes

Reaction equation

HRID 671858 reaction equation
[C:31]([O:32][BH-:33]([O:34][C:35](=[O:36])[CH3:37])[O:38][C:39](=[O:40])[CH3:41])(=[O:42])[CH3:43].[CH2:25]1[CH2:26][O:27][CH2:28][CH2:29][NH:30]1.[CH3:45][C:46](=[O:47])[OH:48].[Cl:49][CH2:50][CH2:51][Cl:52].[F:1][c:2]1[c:3](-[c:9]2[o:10][c:11](-[c:17]3[cH:18][c:19]([CH:23]=[O:24])[cH:20][cH:21][cH:22]3)[c:12]([C:14](=[O:15])[NH2:16])[n:13]2)[c:4]([F:8])[cH:5][cH:6][cH:7]1.[Na+:44]>>[F:1][c:2]1[c:3](-[c:9]2[o:10][c:11](-[c:17]3[cH:18][c:19]([CH2:23][N:30]4[CH2:25][CH2:26][O:27][CH2:28][CH2:29]4)[cH:20][cH:21][cH:22]3)[c:12]([C:14](=[O:15])[NH2:16])[n:13]2)[c:4]([F:8])[cH:5][cH:6][cH:7]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 923Sodium ionHCID 8083MorpholineHCID 2724942TriacetoxyborohydrideHCID 59587462HCID 59587462, compound

Product 1

HCID 59587376HCID 59587376, compound

Sources & evidence

ORD record
ord-78fb3da2519747b4b7868d2c8a1cbe94
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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