1,2-Dichloroethane → HCID 178521726, compound

HRID 2134455Notes

Reaction equation

HRID 2134455 reaction equation
[C:46](=[O:47])([OH:48])[O-:49].[CH2:42]([Cl:43])[CH2:44][Cl:45].[Na+:50].[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][c:9]3[c:10]([nH:11][c:12](-[c:14]4[n:15][n:16]([CH:24]5[O:25][CH2:26][CH2:27][CH2:28][CH2:29]5)[c:17]5[cH:18][cH:19][c:20]([NH2:23])[cH:21][c:22]45)[n:13]3)[cH:30][cH:31]2)[CH2:5][CH2:6]1.[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[OH:51][C:52](=[O:53])[CH:54]1[CH2:55][CH2:56]1.[n:32]1([OH:33])[c:34]2[cH:35][cH:36][cH:37][cH:38][c:39]2[n:40][n:41]1>>[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][c:9]3[c:10]([nH:11][c:12](-[c:14]4[n:15][n:16]([CH:24]5[O:25][CH2:26][CH2:27][CH2:28][CH2:29]5)[c:17]5[cH:18][cH:19][c:20]([NH:23][C:52](=[O:51])[CH:54]6[CH2:55][CH2:56]6)[cH:21][c:22]45)[n:13]3)[cH:30][cH:31]2)[CH2:5][CH2:6]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 769Bicarbonate IonHCID 923Sodium ionHCID 6228DimethylformamideHCID 15655Cyclopropanecarboxylic acidHCID 757711-HydroxybenzotriazoleHCID 178507237HCID 178507237, compound

Product 1

HCID 178521726HCID 178521726, compound

Sources & evidence

ORD record
ord-b4a6c647373442de817868d995634dde
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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