Hydrochloric Acid → HCID 66832108, compound

HRID 303552Notes

Reaction equation

HRID 303552 reaction equation
[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[Cl:21][c:22]1[cH:23][c:24]2[c:25]([CH2:31][CH2:32][NH2:33])[cH:26][nH:27][c:28]2[cH:29][cH:30]1.[ClH:20].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][c:7]2[n:8][c:9]([C:12](=[O:13])[O-:14])[n:10][o:11]2)[cH:15][cH:16][cH:17]1)([F:18])[F:19].[Na+:64].[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[OH-:63].[OH2:65].[P-:34]([F:35])([F:36])([F:37])([F:38])([F:39])[F:40].[n:41]1([O:42][C:43]([N:44]([CH3:45])[CH3:46])=[N+:47]([CH3:48])[CH3:49])[c:50]2[n:51][cH:52][cH:53][cH:54][c:55]2[n:56][n:57]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][c:7]2[n:8][c:9]([C:12](=[O:14])[NH:33][CH2:32][CH2:31][c:25]3[c:24]4[cH:23][c:22]([Cl:21])[cH:30][cH:29][c:28]4[nH:27][cH:26]3)[n:10][o:11]2)[cH:15][cH:16][cH:17]1)([F:18])[F:19]

Participants

11

Reactant 10

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 9886HexafluorophosphateHCID 773795-ChlorotryptamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 86663843HCID 86663843, compound

Product 1

HCID 66832108HCID 66832108, compound

Sources & evidence

ORD record
ord-63dd15da5c3f4761b360d0020db04269
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…