1,2-Dichloroethane → HCID 76741279, compound

HRID 2142441Notes

Reaction equation

HRID 2142441 reaction equation
[CH2:27]([Cl:28])[CH2:29][Cl:30].[CH:1]12[N:2]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[CH2:3][CH:4]([NH:5][CH2:6]1)[CH2:7]2.[Cl:41][CH2:42][Cl:43].[OH2:44].[OH:15][C:16](=[O:17])[c:18]1[n:19][c:20]2[cH:21][cH:22][cH:23][cH:24][c:25]2[nH:26]1.[OH:31][n:32]1[c:33]2[c:34]([cH:35][cH:36][cH:37][cH:38]2)[n:39][n:40]1>>[CH:1]12[N:2]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[CH2:3][CH:4]([N:5]([C:16](=[O:15])[c:18]3[nH:19][c:20]4[cH:21][cH:22][cH:23][cH:24][c:25]4[n:26]3)[CH2:6]1)[CH2:7]2

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 962WaterHCID 6344DichloromethaneHCID 757711-HydroxybenzotriazoleHCID 2332402-Benzimidazolecarboxylic acidHCID 2760898(1S,4S)-tert-butyl 2,5-diazabicyclo(2.2.1)heptane-2-carboxylate

Product 1

HCID 76741279HCID 76741279, compound

Sources & evidence

ORD record
ord-7e7b284b22ea4e119f257ed6558adcaa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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