Dichloromethane → HCID 57863459, compound

HRID 1554839Notes

Reaction equation

HRID 1554839 reaction equation
[C:46]([CH3:47])([CH3:48])([CH3:49])[c:50]1[cH:51][c:52]([NH2:55])[n:53][o:54]1.[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[Cl:34][C:35]([Cl:36])([O:37][C:38]([O:39][C:40]([Cl:41])([Cl:42])[Cl:43])=[O:44])[Cl:45].[Cl:56][CH2:57][Cl:58].[n:1]1[cH:2][cH:3][c:4](-[c:7]2[cH:8][c:9]3[n:10]([cH:11][cH:12]2)[c:13](-[c:16]2[cH:17][c:18]([C:23]([F:24])([F:25])[F:26])[c:19]([NH2:22])[cH:20][cH:21]2)[cH:14][n:15]3)[cH:5][cH:6]1>>[n:1]1[cH:2][cH:3][c:4](-[c:7]2[cH:8][c:9]3[n:10]([cH:11][cH:12]2)[c:13](-[c:16]2[cH:17][c:18]([C:23]([F:24])([F:25])[F:26])[c:19]([NH:22][C:38](=[O:44])[NH:55][c:52]4[cH:51][c:50]([C:46]([CH3:47])([CH3:48])[CH3:49])[o:54][n:53]4)[cH:20][cH:21]2)[cH:14][n:15]3)[cH:5][cH:6]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 94429TriphosgeneHCID 1714733-Isoxazolamine, 5-(1,1-dimethylethyl)-HCID 68543253HCID 68543253, compound

Product 1

HCID 57863459HCID 57863459, compound

Sources & evidence

ORD record
ord-cb13ffb8adbe4ee19be3bdb4d6b08af8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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