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Bicarbonate Ion → 3-(3-Cyano-phenyl)-2-methyl-propionic acid methyl ester

HRID 86499
Notes
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Reaction equation

HRID 86499 reaction equation
[CH2:31]1[O:32][CH2:33][CH2:34][CH2:35]1.[CH3:15][Si:16]([N-:17][Si:18]([CH3:19])([CH3:20])[CH3:21])([CH3:22])[CH3:23].[CH3:1][O:2][C:3]([CH2:4][CH2:5][c:6]1[cH:7][c:8]([C:12]#[N:13])[cH:9][cH:10][cH:11]1)=[O:14].[Na+:24].[Na+:29].[O-:25][C:26]([OH:27])=[O:28].[OH2:30]>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[cH:7][c:8]([C:12]#[N:13])[cH:9][cH:10][cH:11]1)[CH3:15])=[O:14]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium Ion2×HCID 962WaterHCID 8028TetrahydrofuranHCID 3280088Npc316347HCID 20257048Methyl 3-(3-cyanophenyl)propanoate

Product 1

HCID 545230243-(3-Cyano-phenyl)-2-methyl-propionic acid methyl ester

Sources & evidence

ORD record
ord-d46f78d3af7f4cf9ac71c6f1b8455934
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes