Water → 2-Neopentylanthraquinone

HRID 1559545Notes

Reaction equation

HRID 1559545 reaction equation
[CH2:1]([C:2]([CH3:3])([CH3:4])[CH3:5])[c:6]1[cH:7][cH:8][c:9]([C:10](=[O:11])[c:12]2[c:13]([C:14](=[O:15])[OH:16])[cH:17][cH:18][cH:19][cH:20]2)[cH:21][cH:22]1.[OH2:28].[S:23](=[O:24])(=[O:25])([OH:26])[OH:27]>>[CH2:1]([C:2]([CH3:3])([CH3:4])[CH3:5])[c:6]1[cH:7][c:8]2[c:9]([cH:21][cH:22]1)[C:10](=[O:11])[c:12]1[c:13]([cH:17][cH:18][cH:19][cH:20]1)[C:14]2=[O:16]

Participants

4

Reactant 3

HCID 962WaterHCID 1118Sulfuric AcidHCID 140079172-(4-Neopentylbenzoyl)-benzoic acid

Product 1

HCID 144530162-Neopentylanthraquinone

Sources & evidence

ORD record
ord-51ee57f6af994acd97612ac388a5ce61
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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