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Ethanol → Hydrochloric Acid

HRID 831357
Notes
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Reaction equation

HRID 831357 reaction equation
[C:33](=[O:34])([O-:35])[OH:36].[CH3:38][CH2:39][OH:40].[Cl:1][N:2]1[NH:3][CH:4]=[c:5]2[c:6]([Cl:12])[cH:7][cH:8][cH:9][c:10]2=[CH:11]1.[NH:13]1[CH2:14][CH2:15][CH:16]([CH2:19][CH2:20][O:21][c:22]2[cH:23][cH:24][c:25]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[cH:31][cH:32]2)[CH2:17][CH2:18]1.[Na+:37]>>[ClH:1].[N:2]1([N:13]2[CH2:14][CH2:15][CH:16]([CH2:19][CH2:20][O:21][c:22]3[cH:23][cH:24][c:25]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[cH:31][cH:32]3)[CH2:17][CH2:18]2)[NH:3][CH:4]=[c:5]2[c:6]([Cl:12])[cH:7][cH:8][cH:9][c:10]2=[CH:11]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 5

HCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium IonHCID 14989200Ethyl 4-[2-(4-piperidinyl)ethoxy]benzoateHCID 197482793,8-Dichlorophthalazine

Product 2

HCID 313Hydrochloric Acid
HCID 19748241
ethyl 4-[2-[1-(5-chloro-3H-phthalazin-2-yl)piperidin-4-yl]ethoxy]benzoate

Sources & evidence

ORD record
ord-73d3b9ca2b844e8d9fd561c067470718
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes