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Hydrogen Bromide → HCID 178435524, compound

HRID 1537176
Notes
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Reaction equation

HRID 1537176 reaction equation
[BrH:1].[C:41](=[O:42])([OH:43])[O-:44].[CH2:23]([CH3:24])[CH:25]1[CH2:26][CH2:27][c:28]2[cH:29][cH:30][c:31]([N:34]3[N:35]=[C:36]([CH3:40])[CH2:37][C:38]3=[O:39])[cH:32][c:33]21.[CH3:47][CH2:48][OH:49].[ClH:46].[N:19]([O-:20])=[O:21].[NH2:2][c:3]1[c:4]([OH:18])[c:5](-[c:9]2[cH:10][c:11]([C:15](=[O:16])[OH:17])[cH:12][cH:13][cH:14]2)[cH:6][cH:7][cH:8]1.[Na+:22].[Na+:45]>>[NH:2]([c:3]1[c:4]([OH:18])[c:5](-[c:9]2[cH:10][c:11]([C:15](=[O:16])[OH:17])[cH:12][cH:13][cH:14]2)[cH:6][cH:7][cH:8]1)[N:19]=[C:37]1[C:36]([CH3:40])=[N:35][N:34]([c:31]2[cH:30][cH:29][c:28]3[c:33]([cH:32]2)[CH:25]([CH2:23][CH3:24])[CH2:26][CH2:27]3)[C:38]1=[O:39]
ParticipantsSources & evidenceReaction notes

Participants

9

Reactant 8

HCID 260Hydrogen BromideHCID 313Hydrochloric AcidHCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium Ion2×HCID 946NitriteHCID 114923323-(3-Amino-2-hydroxyphenyl)benzoic acid
HCID 57483783
2-(3-Ethyl-indan-5-yl)-5-methyl-2,4-dihydro-pyrazol-3-one

Product 1

HCID 178435524HCID 178435524, compound

Sources & evidence

ORD record
ord-14cc5c969006437c98f900cc22778994
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