Citric Acid → Methyl 2-[1-(3-chloro-2-pyridinyl)pyrazolo[5,4-d]pyrimidin-4-yl]oxy-3-ethoxypropanoate

HRID 112638Notes

Reaction equation

HRID 112638 reaction equation
[CH2:3]([CH3:4])[O:5][CH2:6][CH:7]([C:8](=[O:9])[O:10][CH3:11])[OH:12].[Cl:13][c:14]1[c:15]2[c:16]([n:17][cH:18][n:19]1)[n:20](-[c:23]1[n:24][cH:25][cH:26][cH:27][c:28]1[Cl:29])[n:21][cH:22]2.[H-:1].[Na+:2].[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1.[OH:30][C:31]([CH2:32][C:33]([C:34](=[O:35])[OH:36])([CH2:37][C:38](=[O:39])[OH:40])[OH:41])=[O:42]>>[CH2:3]([CH3:4])[O:5][CH2:6][CH:7]([C:8](=[O:9])[O:10][CH3:11])[O:12][c:14]1[c:15]2[c:16]([n:17][cH:18][n:19]1)[n:20](-[c:23]1[n:24][cH:25][cH:26][cH:27][c:28]1[Cl:29])[n:21][cH:22]2

Participants

7

Reactant 6

HCID 311Citric AcidHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 166653HydrideHCID 57453770HCID 57453770, compoundHCID 575044824-Chloro-1-(3-chloropyridin-2-YL)-1H-pyrazolo[3,4-D]pyrimidine

Product 1

HCID 57504625Methyl 2-[1-(3-chloro-2-pyridinyl)pyrazolo[5,4-d]pyrimidin-4-yl]oxy-3-ethoxypropanoate

Sources & evidence

ORD record
ord-3be766953d4a4bf192ccc43b66e5a6ea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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