Ammonium → HCID 178430511, compound

HRID 1541309Notes

Reaction equation

HRID 1541309 reaction equation
[CH3:53][OH:54].[CH3:55][C:56]#[N:57].[CH3:58][CH2:59][CH2:60][CH2:61][CH2:62][CH2:63][CH3:64].[CH:47]([O-:48])=[O:49].[Cl:1][c:2]1[n:3][c:4]([N:32]2[CH:33]([CH3:39])[CH2:34][N:35]([CH3:38])[CH2:36][CH2:37]2)[c:5]([F:31])[c:6]([NH:8][NH:9][C:10]([CH:11]([CH2:12][N:13]([CH:14]=[O:15])[O:16][CH2:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[CH2:24][CH:25]2[CH2:26][CH2:27][CH2:28][CH2:29]2)=[O:30])[n:7]1.[ClH:46].[F:40][CH:41]([F:42])[C:43](=[NH:44])[NH2:45].[NH4+:50].[NH4+:52].[OH-:51]>>[Cl:1][c:2]1[n:3][c:4]([N:32]2[CH:33]([CH3:39])[CH2:34][N:35]([CH3:38])[CH2:36][CH2:37]2)[c:5]([F:31])[c:6]([NH:8][NH:9][C:10]([CH:11]([CH2:12][N:13]([CH:14]=[O:15])[OH:16])[CH2:24][CH:25]2[CH2:26][CH2:27][CH2:28][CH2:29]2)=[O:30])[n:7]1

Participants

10

Reactant 9

HCID 223Ammonium2×HCID 283FormateHCID 313Hydrochloric AcidHCID 887MethanolHCID 961HydroxideHCID 6342AcetonitrileHCID 8900HeptaneHCID 26597148HCID 26597148, compoundHCID 178430510HCID 178430510, compound

Product 1

HCID 178430511HCID 178430511, compound

Sources & evidence

ORD record
ord-d4c8219ed33142f0981e6a870a3fb913
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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