Ethyl Acetate → HCID 53312110, compound

HRID 168478Notes

Reaction equation

HRID 168478 reaction equation
[C:32]([O:33][CH2:34][CH3:35])(=[O:36])[CH3:37].[CH3:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH3:44].[Cl:1][c:2]1[cH:3][c:4]([N:27]([CH3:28])[CH:29]2[CH2:30][CH2:31]2)[c:5]([NH:9][C:10]([c:11]2[cH:12][n:13][cH:14][cH:15][c:16]2[O:17][c:18]2[c:19]([Cl:25])[cH:20][cH:21][c:22]([Cl:24])[cH:23]2)=[O:26])[cH:6][c:7]1[F:8]>>[Cl:1][c:2]1[cH:3][c:4]([N:27]([CH3:28])[CH:29]2[CH2:30][CH2:31]2)[c:5]([N:9]([C:10]([c:11]2[cH:12][n:13][cH:14][cH:15][c:16]2[O:17][c:18]2[c:19]([Cl:25])[cH:20][cH:21][c:22]([Cl:24])[cH:23]2)=[O:26])[CH3:32])[cH:6][c:7]1[F:8]

Participants

4

Reactant 3

HCID 8857Ethyl AcetateHCID 8900HeptaneHCID 67320677HCID 67320677, compound

Product 1

HCID 53312110HCID 53312110, compound

Sources & evidence

ORD record
ord-e177d4899fb14017ac0cea427e0ea6ca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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