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Ammonium → 4-{3-Chloro-4-[2-hydroxy-1-methyl-2-(2-methyl-pyridin-4-yl)-ethyl]-phenoxy}-benzonitrile

HRID 192035
Notes
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Reaction equation

HRID 192035 reaction equation
[Br:6][c:7]1[cH:8][c:9]([CH3:13])[n:10][cH:11][cH:12]1.[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:1][CH2:2][CH2:3][CH2:4][Li:5].[CH3:36][CH2:37][CH2:38][CH2:39][CH2:40][CH3:41].[Cl-:34].[Cl:14][c:15]1[cH:16][c:17]([O:18][c:19]2[cH:20][cH:21][c:22]([C:23]#[N:24])[cH:25][cH:26]2)[cH:27][cH:28][c:29]1[CH:30]([CH:31]=[O:32])[CH3:33].[NH4+:35]>>[c:7]1([CH:31]([CH:30]([c:29]2[c:15]([Cl:14])[cH:16][c:17]([O:18][c:19]3[cH:20][cH:21][c:22]([C:23]#[N:24])[cH:25][cH:26]3)[cH:27][cH:28]2)[CH3:33])[OH:32])[cH:8][c:9]([CH3:13])[n:10][cH:11][cH:12]1
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 8028TetrahydrofuranHCID 8058HexaneHCID 27628354-Bromo-2-methylpyridineHCID 866459484-[3-Chloro-4-(1-methyl-2-oxo-ethyl)-phenoxy]-benzonitrileHCID 178418339Butyllithium

Product

1
HCID 666990954-{3-Chloro-4-[2-hydroxy-1-methyl-2-(2-methyl-pyridin-4-yl)-ethyl]-phenoxy}-benzonitrile

Sources & evidence

ORD record
ord-071822b4477f4c38ba03bc739517d00a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes