Ethanol → HCID 178510412, compound

HRID 1536880Notes

Reaction equation

HRID 1536880 reaction equation
[CH3:43][CH2:44][OH:45].[Cl:53][CH2:54][Cl:55].[F:46][C:47]([F:48])([F:49])[C:50]([OH:51])=[O:52].[OH:1][CH2:2][CH2:3][NH:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([c:13]2[cH:14][c:15]([C:37]3=[CH:38][CH2:39][CH2:40][CH2:41][CH2:42]3)[c:16]([NH:19][C:20](=[O:21])[c:22]3[n:23]([CH2:29][O:30][CH2:31][CH2:32][Si:33]([CH3:34])([CH3:35])[CH3:36])[cH:24][c:25]([C:27]#[N:28])[n:26]3)[cH:17][cH:18]2)[CH2:11][CH2:12]1>>[OH:1][CH2:2][CH2:3][NH:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([c:13]2[cH:14][c:15]([C:37]3=[CH:38][CH2:39][CH2:40][CH2:41][CH2:42]3)[c:16]([NH:19][C:20](=[O:21])[c:22]3[nH:23][cH:24][c:25]([C:27]#[N:28])[n:26]3)[cH:17][cH:18]2)[CH2:11][CH2:12]1

Participants

5

Reactant 4

HCID 702EthanolHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 56834056HCID 56834056, compound

Product 1

HCID 178510412HCID 178510412, compound

Sources & evidence

ORD record
ord-afda35d8c03d485a80c9e229773657d8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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