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Carbonate Ion → 2,5-Difluoro-4-[3-(2-hydroxypropan-2-yl)-2-methylpyrrolidin-1-yl]-3-methoxybenzonitrile

HRID 2325417
Notes
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Reaction equation

HRID 2325417 reaction equation
[F:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][c:7]([F:13])[c:8]([F:12])[c:9]1[O:10][CH3:11].[Li+:24].[Li+:25].[O-:26][C:27](=[O:28])[O-:29].[OH:14][C:15]([CH3:16])([CH3:17])[CH:18]1[CH:19]([CH3:23])[NH:20][CH2:21][CH2:22]1>>[F:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][c:7]([F:13])[c:8]([N:20]2[CH:19]([CH3:23])[CH:18]([C:15]([OH:14])([CH3:16])[CH3:17])[CH2:22][CH2:21]2)[c:9]1[O:10][CH3:11]
ParticipantsSources & evidenceReaction notes

Participants

5

Reactant 4

HCID 19660Carbonate IonHCID 28486Lithium ion2×HCID 140963703-Methoxy-2,4,5-trifluorobenzonitrileHCID 762252362-(2-Methylpyrrolidin-3-yl)propan-2-ol

Product 1

HCID 722727252,5-Difluoro-4-[3-(2-hydroxypropan-2-yl)-2-methylpyrrolidin-1-yl]-3-methoxybenzonitrile

Sources & evidence

ORD record
ord-8959ee3b97b94dd7a0b9a34ec3383c1f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes