Ammonium → HCID 11421894, compound

HRID 688071Notes

Reaction equation

HRID 688071 reaction equation
[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[Cl-:40].[Cl:34][C:35](=[O:36])[O:37][CH2:38][CH3:39].[Cl:3][c:4]1[c:5](-[n:15]2[n:16][c:17]([C:32]#[N:33])[c:18]([S:25](=[O:26])(=[O:27])[C:28]([F:29])([F:30])[F:31])[c:19]2[N:20]([CH3:21])[CH2:22][CH2:23][OH:24])[c:6]([Cl:14])[cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1.[H-:1].[NH4+:41].[Na+:2].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1>>[Cl:3][c:4]1[c:5](-[n:15]2[n:16][c:17]([C:32]#[N:33])[c:18]([S:25](=[O:26])(=[O:27])[C:28]([F:29])([F:30])[F:31])[c:19]2[N:20]([CH3:21])[CH2:22][CH2:23][O:24][C:35](=[O:36])[O:37][CH2:38][CH3:39])[c:6]([Cl:14])[cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1

Participants

9

Reactant 8

HCID 223AmmoniumHCID 312ChlorideHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 10928Ethyl chloroformateHCID 166653HydrideHCID 86611439HCID 86611439, compound

Product 1

HCID 11421894HCID 11421894, compound

Sources & evidence

ORD record
ord-e2e07845d21c4e1a84531617516a0e93
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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