1,2-Dichloroethane → HCID 136128402, compound

HRID 281745Notes

Reaction equation

HRID 281745 reaction equation
[C:40]([O:41][BH-:42]([O:43][C:44](=[O:45])[CH3:46])[O:47][C:48](=[O:49])[CH3:50])(=[O:51])[CH3:52].[CH3:5][n:6]1[n:7][cH:8][c:9]2[c:15]1[NH:14][c:13]1[c:12]([cH:19][cH:18][c:17]([CH3:20])[cH:16]1)[N:11]([C:21](=[O:22])[c:23]1[cH:24][c:25]([CH3:39])[c:26]([CH2:29][CH2:30][C:31](=[O:32])[N:33]3[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]3)[cH:27][cH:28]1)[CH2:10]2.[CH:1]([CH2:2][CH3:3])=[O:4].[CH:58]([N:59]([CH2:60][CH3:61])[CH:62]([CH3:63])[CH3:64])([CH3:65])[CH3:66].[Cl:54][CH2:55][CH2:56][Cl:57].[Na+:53].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71]>>[CH2:1]([CH2:2][CH3:3])[N:36]1[CH2:35][CH2:34][N:33]([C:31]([CH2:30][CH2:29][c:26]2[c:25]([CH3:39])[cH:24][c:23]([C:21]([N:11]3[CH2:10][c:9]4[cH:8][n:7][n:6]([CH3:5])[c:15]4[NH:14][c:13]4[c:12]3[cH:19][cH:18][c:17]([CH3:20])[cH:16]4)=[O:22])[cH:28][cH:27]2)=[O:32])[CH2:38][CH2:37]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 527PropanalHCID 923Sodium ionHCID 6228DimethylformamideHCID 81531DiisopropylethylamineHCID 2724942TriacetoxyborohydrideHCID 136128407HCID 136128407, compound

Product 1

HCID 136128402HCID 136128402, compound

Sources & evidence

ORD record
ord-b699f62ef3b0459cb6026234893e05f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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