1,2-Dichloroethane → HCID 178430436, compound

HRID 288096Notes

Reaction equation

HRID 288096 reaction equation
[C:32]([O:33][BH-:34]([O:35][C:36](=[O:37])[CH3:38])[O:39][C:40](=[O:41])[CH3:42])(=[O:43])[CH3:44].[CH3:24][CH:25]1[NH:26][CH:27]([CH3:31])[CH2:28][NH:29][CH2:30]1.[Cl:46][CH2:47][CH2:48][Cl:49].[Cl:50][CH2:51][Cl:52].[Na+:45].[O:1]1[CH2:2][CH2:3][O:4][C:5]12[CH2:6][CH2:7][N:8]([c:11]1[n:12][cH:13][cH:14][cH:15][c:16]1-[c:17]1[s:18][cH:19][c:20]([CH:22]=[O:23])[n:21]1)[CH2:9][CH2:10]2>>[O:1]1[CH2:2][CH2:3][O:4][C:5]12[CH2:6][CH2:7][N:8]([c:11]1[n:12][cH:13][cH:14][cH:15][c:16]1-[c:17]1[s:18][cH:19][c:20]([CH2:22][N:29]3[CH2:28][CH:27]([CH3:31])[NH:26][CH:25]([CH3:24])[CH2:30]3)[n:21]1)[CH2:9][CH2:10]2

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 923Sodium ionHCID 6344DichloromethaneHCID 660562,6-DimethylpiperazineHCID 2724942TriacetoxyborohydrideHCID 87323127HCID 87323127, compound

Product 1

HCID 178430436HCID 178430436, compound

Sources & evidence

ORD record
ord-7281751a057b43dd8b7588ea5c53baea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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