Water → HCID 135759121, compound

HRID 90114Notes

Reaction equation

HRID 90114 reaction equation
[Br:23][CH2:24][CH:25]1[CH2:26][CH2:27]1.[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[CH3:36][C:37]#[N:38].[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:22]1)[N:7]=[C:8]([N:16]1[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]1)[c:9]1[c:10]([n:12][n:13]([CH3:15])[cH:14]1)[NH:11]2.[OH2:35]>>[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:22]1)[N:7]=[C:8]([N:16]1[CH2:17][CH2:18][N:19]([CH2:24][CH:25]3[CH2:26][CH2:27]3)[CH2:20][CH2:21]1)[c:9]1[c:10]([n:12][n:13]([CH3:15])[cH:14]1)[NH:11]2

Participants

6

Reactant 5

HCID 962WaterHCID 6342AcetonitrileHCID 8471TriethylamineHCID 81503BromomethylcyclopropaneHCID 135759115HCID 135759115, compound

Product 1

HCID 135759121HCID 135759121, compound

Sources & evidence

ORD record
ord-25db1ee6be7641159caf9e2d3f34c255
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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