Water → HCID 86629444, compound

HRID 671333Notes

Reaction equation

HRID 671333 reaction equation
[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[Cl:1][c:2]1[n:3][cH:4][c:5]([CH2:10][NH:11][c:12]2[c:13]([CH3:22])[cH:14][c:15]([F:21])[c:16]([N+:18](=[O:19])[O-:20])[cH:17]2)[c:6]([NH:8][CH3:9])[cH:7]1.[Cl:30][C:31]([Cl:32])=[O:33].[O:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1.[OH2:34]>>[Cl:1][c:2]1[n:3][cH:4][c:5]2[c:6]([cH:7]1)[N:8]([CH3:9])[C:31](=[O:33])[N:11]([c:12]1[c:13]([CH3:22])[cH:14][c:15]([F:21])[c:16]([N+:18](=[O:19])[O-:20])[cH:17]1)[CH2:10]2

Participants

6

Reactant 5

HCID 962WaterHCID 6371PhosgeneHCID 8471TriethylamineHCID 312751,4-DioxaneHCID 86629445HCID 86629445, compound

Product 1

HCID 86629444HCID 86629444, compound

Sources & evidence

ORD record
ord-c718facce58e447aa8efea60b05cef15
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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