1-Propanol → HCID 59856773, compound

HRID 290393Notes

Reaction equation

HRID 290393 reaction equation
[C:49](=[O:50])([O-:51])[O-:52].[CH3:31][CH2:32][CH2:33][OH:34].[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([O:13][c:14]2[n:15][cH:16][n:17][c:18]([NH:22][c:23]3[c:24]([F:30])[cH:25][c:26]([I:29])[cH:27][cH:28]3)[c:19]2[C:20]#[N:21])[CH2:11][CH2:12]1.[Cs+:53].[Cs+:54].[Cu:61]([I:62])[I:63].[O:55]1[CH2:56][CH2:57][O:58][CH2:59][CH2:60]1.[cH:35]1[cH:36][c:37]2[cH:38][cH:39][c:40]3[c:41]([c:42]2[n:43][cH:44]1)[n:45][cH:46][cH:47][cH:48]3>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([O:13][c:14]2[n:15][cH:16][n:17][c:18]([NH:22][c:23]3[c:24]([F:30])[cH:25][c:26]([O:34][CH2:33][CH2:32][CH3:31])[cH:27][cH:28]3)[c:19]2[C:20]#[N:21])[CH2:11][CH2:12]1

Participants

8

Reactant 7

HCID 10311-PropanolHCID 13181,10-PhenanthrolineHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 83717Copper iodideHCID 104967Cesium cation2×HCID 67202884HCID 67202884, compound

Product 1

HCID 59856773HCID 59856773, compound

Sources & evidence

ORD record
ord-7693732012eb405fadf3fed1214d308a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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