1,2-Dichloroethane → HCID 53467175, compound

HRID 1200368Notes

Reaction equation

HRID 1200368 reaction equation
[C:1]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[C:59]([OH:60])(=[O:61])[CH3:62].[CH2:54]1[O:55][CH2:56][CH2:57][CH2:58]1.[CH3:51][NH:52][CH3:53].[Cl:63][CH2:64][CH2:65][Cl:66].[NH2:15][c:16]1[n:17][cH:18][c:19](-[c:43]2[cH:44][c:45]([CH:46]=[O:47])[cH:48][cH:49][cH:50]2)[c:20]2[c:21]1[c:22](-[c:25]1[cH:26][c:27]3[c:31]([cH:32][cH:33]1)[N:30]([C:34]([CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)=[O:42])[CH2:29][CH2:28]3)[cH:23][s:24]2.[Na+:14]>>[NH2:15][c:16]1[n:17][cH:18][c:19](-[c:43]2[cH:44][c:45]([CH2:46][N:52]([CH3:51])[CH3:53])[cH:48][cH:49][cH:50]2)[c:20]2[c:21]1[c:22](-[c:25]1[cH:26][c:27]3[c:31]([cH:32][cH:33]1)[N:30]([C:34]([CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)=[O:42])[CH2:29][CH2:28]3)[cH:23][s:24]2

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 674DimethylamineHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 2724942TriacetoxyborohydrideHCID 86663679HCID 86663679, compound

Product 1

HCID 53467175HCID 53467175, compound

Sources & evidence

ORD record
ord-1155137af76845459eb62c3e4d8a0fb8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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