O-Xylene → HCID 22503267, compound

HRID 1130887Notes

Reaction equation

HRID 1130887 reaction equation
[Br:26][c:27]1[n:28][c:29]([N:37]2[CH2:38][CH2:39][N:40]([CH:43]=[O:44])[CH2:41][CH2:42]2)[c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]2[cH:36]1.[CH2:1]([CH2:2][CH3:3])[S:4](=[O:5])(=[O:6])[c:7]1[cH:8][cH:9][c:10]([Sn:13]([CH2:14][CH2:15][CH2:16][CH3:17])([CH2:18][CH2:19][CH2:20][CH3:21])[CH2:22][CH2:23][CH2:24][CH3:25])[cH:11][cH:12]1.[CH3:53][CH2:54][O:55][C:56](=[O:57])[CH3:58].[c:45]1([CH3:46])[c:47]([CH3:48])[cH:49][cH:50][cH:51][cH:52]1>>[CH2:1]([CH2:2][CH3:3])[S:4](=[O:5])(=[O:6])[c:7]1[cH:8][cH:9][c:10](-[c:27]2[n:28][c:29]([N:37]3[CH2:38][CH2:39][N:40]([CH:43]=[O:44])[CH2:41][CH2:42]3)[c:30]3[cH:31][cH:32][cH:33][cH:34][c:35]3[cH:36]2)[cH:11][cH:12]1

Participants

5

Reactant 4

HCID 7237O-XyleneHCID 8857Ethyl AcetateHCID 22502676HCID 22502676, compoundHCID 22503150HCID 22503150, compound

Product 1

HCID 22503267HCID 22503267, compound

Sources & evidence

ORD record
ord-dc28d4095f194f54bcd9da46f106013a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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