O-Xylene → 141548-31-4

HRID 2335870Notes

Reaction equation

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

Participants

Reactant 3

HCID 7237O-Xylene

HCID 31215Triethyl phosphite

HCID 229163881,4,5-Triphenyl-3-(7-bromoheptyl)imidazol-2-one

Product 1

HCID 9959140141548-31-4

Sources & evidence

ORD record: ord-2af672537e4b40f1a0d98c8621409fc3
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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