Carbonate Ion → 4-(3-Chloropropyl)-7-fluoro-4H-benzo[1,4]oxazin-3-one

HRID 292546Notes

Reaction equation

HRID 292546 reaction equation
[C:13](=[O:14])([O-:15])[O-:16].[Cl:19][CH2:20][CH2:21][CH2:22][I:23].[Cs+:17].[Cs+:18].[F:1][c:2]1[cH:3][c:4]2[c:5]([cH:11][cH:12]1)[NH:6][C:7](=[O:10])[CH2:8][O:9]2>>[F:1][c:2]1[cH:3][c:4]2[c:5]([cH:11][cH:12]1)[N:6]([CH2:22][CH2:21][CH2:20][Cl:19])[C:7](=[O:10])[CH2:8][O:9]2

Participants

5

Reactant 4

HCID 19660Carbonate IonHCID 813631-Chloro-3-iodopropaneHCID 104967Cesium cation2×HCID 137312957-fluoro-3,4-dihydro-2H-1,4-benzoxazin-3-one

Product 1

HCID 688939964-(3-Chloropropyl)-7-fluoro-4H-benzo[1,4]oxazin-3-one

Sources & evidence

ORD record
ord-04de0f1dff994ab69a4979542fb0853d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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