Ammonium → HCID 123651631, compound

HRID 2330028Notes

Reaction equation

HRID 2330028 reaction equation
[CH3:45][CH2:46][OH:47].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH2:12][CH:13]([CH2:33][S:34](=[O:35])(=[O:36])[c:37]3[cH:38][cH:39][cH:40][cH:41][cH:42]3)[N:14]([c:17]3[cH:18][cH:19][c:20]([C:23]([C:24]([F:25])([F:26])[F:27])([C:28]([F:29])([F:30])[F:31])[OH:32])[cH:21][cH:22]3)[CH2:15][CH2:16]2)[cH:6][n:7]1.[NH4+:43].[OH-:44]>>[c:2]1([NH2:43])[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH2:12][CH:13]([CH2:33][S:34](=[O:35])(=[O:36])[c:37]3[cH:38][cH:39][cH:40][cH:41][cH:42]3)[N:14]([c:17]3[cH:18][cH:19][c:20]([C:23]([C:24]([F:25])([F:26])[F:27])([C:28]([F:29])([F:30])[F:31])[OH:32])[cH:21][cH:22]3)[CH2:15][CH2:16]2)[cH:6][n:7]1

Participants

5

Reactant 4

HCID 223AmmoniumHCID 702EthanolHCID 961HydroxideHCID 123163756HCID 123163756, compound

Product 1

HCID 123651631HCID 123651631, compound

Sources & evidence

ORD record
ord-4624fddbfb454c2e8c37c16d9f26d3ec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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