Hexane → HCID 11504338, compound

HRID 114324Notes

Reaction equation

HRID 114324 reaction equation
[CH3:1][O:2][C:3]([c:4]1[c:5]([NH:12][C:13]([CH:14]([CH3:15])[c:16]2[cH:17][c:18]([Br:30])[c:19]([O:22][CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:20][cH:21]2)=[O:31])[cH:6][c:7]([Cl:11])[cH:8][c:9]1[Cl:10])=[O:32].[CH3:34][Si:35]([N-:36][Si:37]([CH3:38])([CH3:39])[CH3:40])([CH3:41])[CH3:42].[CH3:43][CH2:44][CH2:45][CH2:46][CH2:47][CH3:48].[CH3:49][CH2:50][O:51][C:52]([CH3:53])=[O:54].[Li+:33]>>[C:3]1(=[O:32])[c:4]2[c:5]([cH:6][c:7]([Cl:11])[cH:8][c:9]2[Cl:10])[NH:12][C:13](=[O:31])[C:14]1([CH3:15])[c:16]1[cH:17][c:18]([Br:30])[c:19]([O:22][CH2:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[cH:20][cH:21]1

Participants

6

Reactant 5

HCID 8058HexaneHCID 8857Ethyl AcetateHCID 28486Lithium ionHCID 3280088Npc316347HCID 68819438HCID 68819438, compound

Product 1

HCID 11504338HCID 11504338, compound

Sources & evidence

ORD record
ord-d2dbc637fa304646a30b12c55a1d8dc0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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