Hydrochloric Acid → HCID 178471325, compound

HRID 2329427Notes

Reaction equation

HRID 2329427 reaction equation
[Cl:66][CH2:67][Cl:68].[ClH:10].[NH2:11][CH:12]([CH2:13][CH:14]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[CH3:20])[CH2:21][c:22]1[cH:23][cH:24][c:25](-[c:28]2[c:29]([O:35][CH3:36])[cH:30][cH:31][c:32]([F:34])[cH:33]2)[cH:26][cH:27]1.[O:61]=[CH:62][N:63]([CH3:64])[CH3:65].[OH:1][c:2]1[n:3][o:4][c:5]([C:7](=[O:8])[OH:9])[cH:6]1.[P-:37]([F:38])([F:39])([F:40])([F:41])([F:42])[F:43].[n:44]1([O:45][C:46]([N:47]([CH3:48])[CH3:49])=[N+:50]([CH3:51])[CH3:52])[c:53]2[n:54][cH:55][cH:56][cH:57][c:58]2[n:59][n:60]1>>[OH:1][c:2]1[n:3][o:4][c:5]([C:7](=[O:9])[NH:11][CH:12]([CH2:13][CH:14]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[CH3:20])[CH2:21][c:22]2[cH:23][cH:24][c:25](-[c:28]3[c:29]([O:35][CH3:36])[cH:30][cH:31][c:32]([F:34])[cH:33]3)[cH:26][cH:27]2)[cH:6]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 178471485HCID 178471485, compoundHCID 178524642HCID 178524642, compound

Product 1

HCID 178471325HCID 178471325, compound

Sources & evidence

ORD record
ord-35a20d47adad44898be464db0621fa44
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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