Hexane → HCID 22936271, compound

HRID 2319184Notes

Reaction equation

HRID 2319184 reaction equation
[CH3:21][CH2:22][O:23][C:24](=[O:25])[CH3:26].[CH3:37][CH2:38][CH2:39][CH2:40][CH2:41][CH3:42].[F:27][c:28]1[cH:29][cH:30][c:31]([N:34]=[C:35]=[O:36])[cH:32][cH:33]1.[c:1]1(-[c:7]2[n:8][cH:9][cH:10][c:11]([O:13][c:14]3[cH:15][cH:16][c:17]([NH2:18])[cH:19][cH:20]3)[cH:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[n:8][cH:9][cH:10][c:11]([O:13][c:14]3[cH:15][cH:16][c:17]([NH:18][C:35]([NH:34][c:31]4[cH:30][cH:29][c:28]([F:27])[cH:33][cH:32]4)=[O:36])[cH:19][cH:20]3)[cH:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 8058HexaneHCID 8857Ethyl AcetateHCID 709554-Fluorophenyl isocyanateHCID 22936711HCID 22936711, compound

Product 1

HCID 22936271HCID 22936271, compound

Sources & evidence

ORD record
ord-3379cb316f064a1ba0fbee573fccc4e1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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