1,2-Dichloroethane → HCID 58102836, compound

HRID 2313157Notes

Reaction equation

HRID 2313157 reaction equation
[CH2:29]([Cl:30])[CH2:31][Cl:32].[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[CH3:51][NH2:52].[Cl:54][CH2:55][Cl:56].[ClH:33].[ClH:53].[O:1]=[c:2]1[n:3]([CH:17]2[CH2:18][CH2:19][c:20]3[c:21]([C:26](=[O:27])[OH:28])[cH:22][cH:23][cH:24][c:25]32)[cH:4][cH:5][cH:6][c:7]1[C:8]([NH:9][c:10]1[cH:11][cH:12][n:13][cH:14][cH:15]1)=[O:16].[OH2:57].[OH:34][n:35]1[c:36]2[c:37]([cH:38][cH:39][cH:40][cH:41]2)[n:42][n:43]1>>[O:1]=[c:2]1[n:3]([CH:17]2[CH2:18][CH2:19][c:20]3[c:21]([C:26](=[O:27])[NH:52][CH3:51])[cH:22][cH:23][cH:24][c:25]32)[cH:4][cH:5][cH:6][c:7]1[C:8]([NH:9][c:10]1[cH:11][cH:12][n:13][cH:14][cH:15]1)=[O:16]

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 313Hydrochloric Acid2×HCID 962WaterHCID 6329MethylamineHCID 6344DichloromethaneHCID 8471TriethylamineHCID 757711-HydroxybenzotriazoleHCID 66610329HCID 66610329, compound

Product 1

HCID 58102836HCID 58102836, compound

Sources & evidence

ORD record
ord-3a4b5d9754d747b4b36cac2b415c7168
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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