Ammonium → Sodium ion

HRID 97046Notes

Reaction equation

HRID 97046 reaction equation
[CH3:1][OH:2].[CH3:5][O:6][C:7]([CH2:8][c:9]1[c:10]([F:42])[cH:11][c:12](-[c:15]2[c:16]([CH3:41])[cH:17][c:18]([C:21]([CH2:22][CH3:23])([c:24]3[cH:25][c:26]([CH3:38])[c:27]([CH:30]=[CH:31][C:32]4([OH:37])[CH2:33][CH2:34][CH2:35][CH2:36]4)[cH:28][cH:29]3)[CH2:39][CH3:40])[cH:19][cH:20]2)[cH:13][cH:14]1)=[O:43].[Cl-:44].[NH4+:45].[Na+:4].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[OH-:3]>>[Na+:4].[O:6]=[C:7]([CH2:8][c:9]1[c:10]([F:42])[cH:11][c:12](-[c:15]2[c:16]([CH3:41])[cH:17][c:18]([C:21]([CH2:22][CH3:23])([c:24]3[cH:25][c:26]([CH3:38])[c:27]([CH:30]=[CH:31][C:32]4([OH:37])[CH2:33][CH2:34][CH2:35][CH2:36]4)[cH:28][cH:29]3)[CH2:39][CH3:40])[cH:19][cH:20]2)[cH:13][cH:14]1)[O-:43]

Participants

9

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 67065133Methyl 2-[2-fluoro-4-[4-[3-[4-[2-(1-hydroxycyclopentyl)ethenyl]-3-methylphenyl]pentan-3-yl]-2-methylphenyl]phenyl]acetate

Product 2

HCID 923Sodium ionHCID 178442118HCID 178442118, compound

Sources & evidence

ORD record
ord-9e17e8aaaa484bf6a33bf8e906aba9cd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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