Hydrogen Bromide → HCID 178433836, compound

HRID 1235805Notes

Reaction equation

HRID 1235805 reaction equation
[BrH:1].[C:41](=[O:42])([OH:43])[O-:44].[CH3:23][C:24]1([CH3:40])[CH2:25][c:26]2[cH:27][cH:28][c:29]([N:33]3[N:34]=[C:35]([CH3:39])[CH2:36][C:37]3=[O:38])[cH:30][c:31]2[CH2:32]1.[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:36]1[C:35]([CH3:39])=[N:34][N:33]([c:29]2[cH:28][cH:27][c:26]3[c:31]([cH:30]2)[CH2:32][C:24]([CH3:23])([CH3:40])[CH2:25]3)[C:37]1=[O:38]

Participants

8

Reactant 7

HCID 260Hydrogen BromideHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 946NitriteHCID 114923323-(3-Amino-2-hydroxyphenyl)benzoic acidHCID 574837842-(2,2-Dimethyl-indan-5-yl)-5-methyl-2,4-dihydro-pyrazol-3-one

Product 1

HCID 178433836HCID 178433836, compound

Sources & evidence

ORD record
ord-da5d936caedd43f49928c66dcddaeab9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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