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Theobromine → [3-(3,7-Dimethylxanthin-1-yl)propyl]dimethylphosphine Oxide

HRID 814609
Notes
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Reaction equation

HRID 814609 reaction equation
[CH3:23][CH2:24][O:25][C:26](=[O:27])[CH3:28].[CH3:2][n:3]1[c:4](=[O:14])[nH:5][c:6](=[O:13])[c:7]2[n:8]([CH3:12])[cH:9][n:10][c:11]12.[Cl:15][CH2:16][CH2:17][CH2:18][P:19]([CH3:20])([CH3:21])=[O:22].[Na:1]>>[CH3:2][n:3]1[c:4](=[O:14])[n:5]([CH2:16][CH2:17][CH2:18][P:19]([CH3:20])([CH3:21])=[O:22])[c:6](=[O:13])[c:7]2[n:8]([CH3:12])[cH:9][n:10][c:11]12
ParticipantsSources & evidenceReaction notes

Participants

5

Reactant 4

HCID 5429TheobromineHCID 8857Ethyl AcetateHCID 5360545SodiumHCID 126691413-Chloropropyldimethylphosphine oxide

Product 1

HCID 19689284[3-(3,7-Dimethylxanthin-1-yl)propyl]dimethylphosphine Oxide

Sources & evidence

ORD record
ord-2dd3f34d225841fca7a574692b3464ea
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