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Acetic Acid → HCID 22607239, compound

HRID 160408
Notes
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Reaction equation

HRID 160408 reaction equation
[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:22][CH:23]([N-:24][CH:25]([CH3:26])[CH3:27])[CH3:28].[CH3:37][C:38](=[O:39])[OH:40].[CH3:46][OH:47].[CH3:48][CH2:49][O:50][C:51]([CH3:52])=[O:53].[CH3:8][CH2:9][CH2:10][CH2:11][Li:12].[CH:1]([NH:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7].[CH:29]([c:30]1[cH:31][cH:32][n:33][cH:34][cH:35]1)=[O:36].[F:13][c:14]1[n:15][c:16]([F:20])[cH:17][cH:18][cH:19]1.[Li+:21]>>[F:13][c:14]1[n:15][c:16]([F:20])[cH:17][cH:18][c:19]1[CH:29]([c:30]1[cH:31][cH:32][n:33][cH:34][cH:35]1)[OH:36]
ParticipantsSources & evidenceReaction notes

Participants

11

Reactant 10

HCID 176Acetic AcidHCID 887MethanolHCID 7912DiisopropylamineHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 133894-PyridinecarboxaldehydeHCID 28486Lithium ion
HCID 73934
2,6-Difluoropyridine
HCID 5062348Diisopropylamide
HCID 178418339Butyllithium

Product 1

HCID 22607239HCID 22607239, compound

Sources & evidence

ORD record
ord-0c27623517ab4f999fffba6cf20561c2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes