Toluene → HCID 74020637, compound

HRID 169673Notes

Reaction equation

HRID 169673 reaction equation
[Br:29][c:30]1[c:31]([CH2:51][C:52](=[O:53])[O:54][CH3:55])[c:32](-[c:44]2[o:45][c:46]([CH:49]=[O:50])[cH:47][cH:48]2)[c:33]([O:40][CH2:41][O:42][CH3:43])[cH:34][c:35]1[O:36][CH2:37][O:38][CH3:39].[C:1](=[O:2])([O:3][CH3:4])[CH:5]=[C:6]1[CH2:7][CH2:8][P:9]([c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[C:16]1([c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)[c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1>>[C:1](=[O:2])([O:3][CH3:4])[CH:5]=[CH:49][c:46]1[o:45][c:44](-[c:32]2[c:31]([CH2:51][C:52](=[O:53])[O:54][CH3:55])[c:30]([Br:29])[c:35]([O:36][CH2:37][O:38][CH3:39])[cH:34][c:33]2[O:40][CH2:41][O:42][CH3:43])[cH:48][cH:47]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 54561798HCID 54561798, compoundHCID 86613502HCID 86613502, compound

Product 1

HCID 74020637HCID 74020637, compound

Sources & evidence

ORD record
ord-4b0e29d64efa44cb8395576c244cbc94
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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