Benzene → HCID 69062204, compound

HRID 1572538Notes

Reaction equation

HRID 1572538 reaction equation
[C:19](=[O:20])([O-:21])[O-:22].[C:40]([O:41][CH2:42][CH3:43])(=[O:44])[CH3:45].[CH3:1][N:2]1[CH:3]2[CH2:4][CH:5]([S:10][c:11]3[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]3)[CH2:6][CH:7]1[CH2:8][CH2:9]2.[CH3:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39].[Cl:25][C:26]([CH2:27][O:28][C:29](=[O:30])[Cl:31])([Cl:32])[Cl:33].[K+:23].[K+:24].[cH:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[N:2]1([C:29]([O:28][CH2:27][C:26]([Cl:25])([Cl:32])[Cl:33])=[O:30])[CH:3]2[CH2:4][CH:5]([S:10][c:11]3[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]3)[CH2:6][CH:7]1[CH2:8][CH2:9]2

Participants

8

Reactant 7

HCID 241BenzeneHCID 813Potassium Cation2×HCID 8058HexaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 870632,2,2-Trichloroethyl chloroformateHCID 69057681HCID 69057681, compound

Product 1

HCID 69062204HCID 69062204, compound

Sources & evidence

ORD record
ord-e1c8e5d3f4d0431d9d86cb55b405f739
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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