1,2-Dichloroethane → HCID 22724102, compound

HRID 1222282Notes

Reaction equation

HRID 1222282 reaction equation
[C:44](=[O:45])([OH:46])[O-:47].[CH2:53]1[O:54][CH2:55][CH2:56][O:57][CH2:58]1.[CH3:59][CH2:60][N:61]([CH2:62][CH3:63])[CH2:64][CH3:65].[Cl:49][CH2:50][CH2:51][Cl:52].[Cl:7][C:8]([Cl:9])([O:10][C:11]([O:12][C:13]([Cl:14])([Cl:15])[Cl:16])=[O:17])[Cl:18].[NH2:19][c:20]1[cH:21][c:22](-[n:26]2[c:27]3[c:28]([n:29][c:30]([CH2:33][c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[c:31]2=[O:32])[cH:40][cH:41][cH:42][n:43]3)[cH:23][cH:24][cH:25]1.[Na+:48].[OH:1][CH:2]1[CH2:3][CH2:4][CH2:5][CH2:6]1>>[O:1]([CH:2]1[CH2:3][CH2:4][CH2:5][CH2:6]1)[C:11](=[O:17])[NH:19][c:20]1[cH:21][c:22](-[n:26]2[c:27]3[c:28]([n:29][c:30]([CH2:33][c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[c:31]2=[O:32])[cH:40][cH:41][cH:42][n:43]3)[cH:23][cH:24][cH:25]1

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 769Bicarbonate IonHCID 923Sodium ionHCID 7298CyclopentanolHCID 8471TriethylamineHCID 312751,4-DioxaneHCID 94429TriphosgeneHCID 22724309HCID 22724309, compound

Product 1

HCID 22724102HCID 22724102, compound

Sources & evidence

ORD record
ord-91b4234d7e6a418382ffa9094b27c51b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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