Water → HCID 14851849, compound

HRID 152355Notes

Reaction equation

HRID 152355 reaction equation
[CH2:24]([C:25]#[CH:26])[n:27]1[n:28][c:29]2[n:30]([cH:31][cH:32][cH:33][cH:34]2)[c:35]1=[O:36].[CH:37]#[CH:38].[F:1][c:2]1[c:3]([C:8]2=[N:9][CH2:10][c:11]3[n:12]([c:20]([CH3:23])[n:21][n:22]3)-[c:13]3[c:14]2[cH:15][c:16]([I:19])[cH:17][cH:18]3)[cH:4][cH:5][cH:6][cH:7]1.[OH2:39]>>[F:1][c:2]1[c:3]([C:8]2=[N:9][CH2:10][c:11]3[n:12]([c:20]([CH3:23])[n:21][n:22]3)-[c:13]3[c:14]2[cH:15][c:16]([C:26]#[C:25][CH2:24][n:27]2[n:28][c:29]4[n:30]([cH:31][cH:32][cH:33][cH:34]4)[c:35]2=[O:36])[cH:17][cH:18]3)[cH:4][cH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 962WaterHCID 6326AcetyleneHCID 14851835HCID 14851835, compoundHCID 14851942HCID 14851942, compound

Product 1

HCID 14851849HCID 14851849, compound

Sources & evidence

ORD record
ord-8f9e7fa2153348c79723bf2e890f26a4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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