Acetone → HCID 18616138, compound

HRID 191461Notes

Reaction equation

HRID 191461 reaction equation
[CH3:38][C:39](=[O:40])[CH3:41].[N+:1]([O-:2])(=[O:3])[c:4]1[c:5]([O:23][CH2:24][CH2:25][O:26][CH3:27])[cH:6][c:7]2[c:20]([cH:21]1)[CH:19]1[CH:10]([CH2:9][CH2:8]2)[CH:11]2[CH2:12][CH2:13][C:14](=[O:22])[C:15]2([CH3:16])[CH2:17][CH2:18]1.[Na+:29].[Na+:36].[Na+:37].[OH-:28].[OH2:42].[S:30]([S:31]([O-:32])=[O:33])([O-:34])=[O:35]>>[NH2:1][c:4]1[c:5]([O:23][CH2:24][CH2:25][O:26][CH3:27])[cH:6][c:7]2[c:20]([cH:21]1)[CH:19]1[CH:10]([CH2:9][CH2:8]2)[CH:11]2[CH2:12][CH2:13][C:14](=[O:22])[C:15]2([CH3:16])[CH2:17][CH2:18]1

Participants

7

Reactant 6

HCID 180AcetoneHCID 923Sodium ion3×HCID 961HydroxideHCID 962WaterHCID 1086DithioniteHCID 18616157HCID 18616157, compound

Product 1

HCID 18616138HCID 18616138, compound

Sources & evidence

ORD record
ord-dd40a1ab84a94fb6ab690999b284a93e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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