Dichloromethane → HCID 56838045, compound

HRID 687390Notes

Reaction equation

HRID 687390 reaction equation
[CH3:1][c:2]1[c:3]([C:20](=[O:21])[OH:22])[n:4]([CH2:17][CH2:18][CH3:19])[c:5](=[O:16])[c:6]2[cH:7][c:8]([C:12]([F:13])([F:14])[F:15])[cH:9][cH:10][c:11]12.[CH:47]([N:48]([CH2:49][CH3:50])[CH:51]([CH3:52])[CH3:53])([CH3:54])[CH3:55].[Cl:65][CH2:66][Cl:67].[F:56][c:57]1[cH:58][c:59]([CH2:60][NH2:61])[cH:62][cH:63][cH:64]1.[P-:23]([F:24])([F:25])([F:26])([F:27])([F:28])[F:29].[n:30]1([O:31][C:32]([N:33]([CH3:34])[CH3:35])=[N+:36]([CH3:37])[CH3:38])[c:39]2[n:40][cH:41][cH:42][cH:43][c:44]2[n:45][n:46]1>>[CH3:1][c:2]1[c:3]([C:20](=[O:22])[NH:61][CH2:60][c:59]2[cH:58][c:57]([F:56])[cH:64][cH:63][cH:62]2)[n:4]([CH2:17][CH2:18][CH3:19])[c:5](=[O:16])[c:6]2[cH:7][c:8]([C:12]([F:13])([F:14])[F:15])[cH:9][cH:10][c:11]12

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 668533-FluorobenzylamineHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 66611400HCID 66611400, compound

Product 1

HCID 56838045HCID 56838045, compound

Sources & evidence

ORD record
ord-5357f238ceb94692a803b59f0dd3c95e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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