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Hydrochloric Acid → 8-(4-(2-Butoxyethoxy)phenyl)-1-(2-methyl-2-propen-1-yl)-1,2,3,4-tetrahydro-1-benzoazocine-5-carboxylic acid

HRID 200535
Notes
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Reaction equation

HRID 200535 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:34]2)[CH:20]=[C:21]([C:30](=[O:31])[O:32][CH3:33])[CH2:22][CH2:23][CH2:24][N:25]3[CH2:26][C:27](=[CH2:28])[CH3:29])[cH:13][cH:14]1.[CH3:44][OH:45].[ClH:42].[Na+:41].[O:35]1[CH2:36][CH2:37][CH2:38][CH2:39]1.[OH-:40].[OH2:43]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:34]2)[CH:20]=[C:21]([C:30](=[O:31])[OH:32])[CH2:22][CH2:23][CH2:24][N:25]3[CH2:26][C:27](=[CH2:28])[CH3:29])[cH:13][cH:14]1
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 68649885Methyl 8-(4-(2-butoxyethoxy)phenyl)-1-(2-methyl-2-propen-1-yl)-1,2,3,4-tetrahydro-1-benzoazocine-5-carboxylate

Product 1

HCID 686498658-(4-(2-Butoxyethoxy)phenyl)-1-(2-methyl-2-propen-1-yl)-1,2,3,4-tetrahydro-1-benzoazocine-5-carboxylic acid

Sources & evidence

ORD record
ord-58e19f6c12c0437794e8e44ca83aa647
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

Reaction notes

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