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Sodium Ion → Ethyl 2-(1,4-diazepan-1-yl)acetate

HRID 1542651
Notes
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Reaction equation

HRID 1542651 reaction equation
[Br:14][CH2:15][C:16](=[O:17])[O:18][CH2:19][CH3:20].[CH3:21][C:22]#[N:23].[NH:7]1[CH2:8][CH2:9][NH:10][CH2:11][CH2:12][CH2:13]1.[Na+:1].[Na+:2].[O-:3][C:4](=[O:5])[O-:6]>>[N:7]1([CH2:15][C:16](=[O:17])[O:18][CH2:19][CH3:20])[CH2:8][CH2:9][NH:10][CH2:11][CH2:12][CH2:13]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 923Sodium Ion2×HCID 6342AcetonitrileHCID 7748Ethyl bromoacetateHCID 19660Carbonate IonHCID 68163Hexahydro-1,4-diazepine

Product 1

HCID 13057080Ethyl 2-(1,4-diazepan-1-yl)acetate

Sources & evidence

ORD record
ord-e5278830afd84d1c857854a6cf73156f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes