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Methanol → 4,4-Difluoro-2-(1,4-oxazepane-4-carbonylamino)pentanoic acid

HRID 1136480
Notes
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Reaction equation

HRID 1136480 reaction equation
[CH3:1][O:2][C:3]([CH:4]([CH2:5][C:6]([CH3:7])([F:8])[F:9])[NH:10][C:11](=[O:12])[N:13]1[CH2:14][CH2:15][O:16][CH2:17][CH2:18][CH2:19]1)=[O:20].[CH3:23][OH:24].[Li+:21].[O:25]1[CH2:26][CH2:27][CH2:28][CH2:29]1.[OH-:22].[OH2:30]>>[O:2]=[C:3]([CH:4]([CH2:5][C:6]([CH3:7])([F:8])[F:9])[NH:10][C:11](=[O:12])[N:13]1[CH2:14][CH2:15][O:16][CH2:17][CH2:18][CH2:19]1)[OH:20]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 76558769Methyl 4,4-difluoro-2-(1,4-oxazepane-4-carbonylamino)pentanoate

Product 1

HCID 765587644,4-Difluoro-2-(1,4-oxazepane-4-carbonylamino)pentanoic acid

Sources & evidence

ORD record
ord-2955c4560a834a339df26ff4f478676c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes