1,2-Dichloroethane → HCID 178491179, compound

HRID 1572194Notes

Reaction equation

HRID 1572194 reaction equation
[CH2:48]([Cl:49])[CH2:50][Cl:51].[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[ClH:16].[F:17][C:18]([CH:19]([NH2:20])[c:21]1[n:22][cH:23][c:24]([O:27][CH3:28])[cH:25][cH:26]1)([F:29])[F:30].[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH:38][n:39]1[c:40]2[n:41][cH:42][cH:43][cH:44][c:45]2[n:46][n:47]1.[s:1]1[cH:2][c:3](-[c:6]2[cH:7][cH:8][c:9]([CH2:12][C:13](=[O:14])[OH:15])[cH:10][cH:11]2)[cH:4][cH:5]1>>[s:1]1[cH:2][c:3](-[c:6]2[cH:7][cH:8][c:9]([CH2:12][C:13](=[O:15])[NH:20][CH:19]([C:18]([F:17])([F:29])[F:30])[c:21]3[n:22][cH:23][c:24]([O:27][CH3:28])[cH:25][cH:26]3)[cH:10][cH:11]2)[cH:4][cH:5]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 8471TriethylamineHCID 181649HOAtHCID 13773530HCID 13773530, compoundHCID 66893346HCID 66893346, compound

Product 1

HCID 178491179HCID 178491179, compound

Sources & evidence

ORD record
ord-22106d9128a94a2a90767358bbf55092
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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