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Chloride → 7-Amino-1,1-dimethyl-1,2,4,5-tetrahydrobenzo[c]azepin-3-one

HRID 1147993
Notes
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Reaction equation

HRID 1147993 reaction equation
[C:26](=[O:27])([OH:28])[O-:29].[CH2:33]1[O:34][CH2:35][CH2:36][CH2:37]1.[CH3:1][C:2]1([CH3:17])[NH:3][C:4](=[O:16])[CH2:5][CH2:6][c:7]2[c:8]1[cH:9][cH:10][c:11]([N+:13]([O-:14])=[O:15])[cH:12]2.[CH3:38][OH:39].[CH3:41][CH2:42][O:43][C:44]([CH3:45])=[O:46].[Cl-:31].[Na+:24].[Na+:25].[Na+:30].[Na+:32].[OH2:40].[S:18]([S:19]([O-:20])=[O:21])([O-:22])=[O:23]>>[CH3:1][C:2]1([CH3:17])[NH:3][C:4](=[O:16])[CH2:5][CH2:6][c:7]2[c:8]1[cH:9][cH:10][c:11]([NH2:13])[cH:12]2
ParticipantsSources & evidenceReaction notes

Participants

10

Reactant 9

HCID 312ChlorideHCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium Ion4×HCID 962WaterHCID 1086DithioniteHCID 8028TetrahydrofuranHCID 8857Ethyl Acetate

Sources & evidence

ORD record
ord-c220ad1676604b39a98819cd4b7abbe0
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
HCID 672644211,1-Dimethyl-7-nitro-1,2,4,5-tetrahydrobenzo[c]azepin-3-one

Product 1

HCID 672644267-Amino-1,1-dimethyl-1,2,4,5-tetrahydrobenzo[c]azepin-3-one