1-Butanol → HCID 15838056, compound

HRID 2322882Notes

Reaction equation

HRID 2322882 reaction equation
[Br:33][c:34]1[c:35]([CH3:36])[c:37]([C:38]([O:39][CH3:40])=[O:41])[c:42]2[c:43]([cH:44][cH:45][c:46]([F:47])[cH:48]2)[n:49]1.[CH2:50]([OH:51])[CH2:52][CH2:53][CH3:54].[F:1][c:2]1[cH:3][c:4]2[c:5]([C:29](=[O:30])[O:31][CH3:32])[c:6]([CH3:28])[c:7](-[n:12]3[cH:13][n:14][c:15]4[c:16]3[cH:17][c:18]([F:27])[cH:19][c:20]4-[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[n:8][c:9]2[cH:10][cH:11]1>>[F:1][c:2]1[cH:3][c:4]2[c:5]([C:29](=[O:30])[OH:31])[c:6]([CH3:28])[c:7](-[n:12]3[cH:13][n:14][c:15]4[c:16]3[cH:17][c:18]([F:27])[cH:19][c:20]4-[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[n:8][c:9]2[cH:10][cH:11]1

Participants

4

Reactant 3

HCID 2631-ButanolHCID 15838063HCID 15838063, compoundHCID 23368198HCID 23368198, compound

Product 1

HCID 15838056HCID 15838056, compound

Sources & evidence

ORD record
ord-b2a2b82a2e0846d292d4226b8ce3c5c4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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