Hydrochloric Acid → HCID 66831887, compound

HRID 1222578Notes

Reaction equation

HRID 1222578 reaction equation
[CH2:59]1[O:60][CH2:61][CH2:62][CH2:63]1.[Cl:22][c:23]1[cH:24][c:25]2[c:26]([CH2:32][CH2:33][NH2:34])[cH:27][nH:28][c:29]2[cH:30][cH:31]1.[ClH:21].[F:1][c:2]1[c:3]([CH2:4][c:5]2[n:6][c:7]([C:10]([O:12][CH2:11][CH3:13])=[O:14])[n:8][o:9]2)[cH:15][cH:16][c:17]([F:20])[c:18]1[F:19].[Na+:65].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[OH-:64].[OH2:66].[P-:35]([F:36])([F:37])([F:38])([F:39])([F:40])[F:41].[n:42]1([O:43][C:44]([N:45]([CH3:46])[CH3:47])=[N+:48]([CH3:49])[CH3:50])[c:51]2[n:52][cH:53][cH:54][cH:55][c:56]2[n:57][n:58]1>>[F:1][c:2]1[c:3]([CH2:4][c:5]2[n:6][c:7]([C:10](=[O:12])[NH:34][CH2:33][CH2:32][c:26]3[c:25]4[cH:24][c:23]([Cl:22])[cH:31][cH:30][c:29]4[nH:28][cH:27]3)[n:8][o:9]2)[cH:15][cH:16][c:17]([F:20])[c:18]1[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 66831947HCID 66831947, compound

Product 1

HCID 66831887HCID 66831887, compound

Sources & evidence

ORD record
ord-79726101a46342cb88ca41ae0fbf7ceb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…