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Ethanol → Theophylline

HRID 935388
Notes
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Reaction equation

HRID 935388 reaction equation
[C:42]([O:43][CH2:44][CH3:45])(=[O:46])[CH3:47].[CH2:39]([OH:40])[CH3:41].[CH3:23][n:24]1[c:25](=[O:38])[n:26]([CH3:37])[c:27]2[n:28][cH:29][n:30]([CH2:34][C:35]#[CH:36])[c:31]2[c:32]1=[O:33].[Cl:1][c:2]1[cH:3][cH:4][cH:5][cH:6][c:7]1[C:8]1=[N:22][CH2:21][c:20]2[n:15]([c:16]([CH3:17])[n:18][n:19]2)-[c:14]2[c:9]1[cH:10][c:11]([I:12])[s:13]2>>[CH3:23][n:24]1[c:25](=[O:38])[n:26]([CH3:37])[c:27]2[n:28][cH:29][nH:30][c:31]2[c:32]1=[O:33]
ParticipantsSources & evidenceReaction notes

Participants

5

Reactant 4

HCID 702EthanolHCID 8857Ethyl AcetateHCID 1014227-Propargyl 1,3-dimethylxanthineHCID 148519244-(2-chlorophenyl)-2-iodo-9-methyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine

Product 1

HCID 2153Theophylline

Sources & evidence

ORD record
ord-6f34e4fd651e4c5eb1ab09be9a614209
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes