Toluene → HCID 77172672, compound

HRID 2313141Notes

Reaction equation

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([N+:41]([O-:42])=[O:43])[cH:11][c:12]([CH:15]([CH2:16][N:17]([C:18]2([CH3:29])[CH2:19][c:20]3[cH:21][c:22]([CH3:28])[c:23]([CH3:27])[cH:24][c:25]3[CH2:26]2)[CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[O:37][C:38]([CH3:39])=[O:40])[cH:13][cH:14]1.[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([NH2:41])[cH:11][c:12]([CH:15]([CH2:16][N:17]([C:18]2([CH3:29])[CH2:19][c:20]3[cH:21][c:22]([CH3:28])[c:23]([CH3:27])[cH:24][c:25]3[CH2:26]2)[CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[O:37][C:38]([CH3:39])=[O:40])[cH:13][cH:14]1

Participants

Reactant 3

HCID 1140Toluene

HCID 8028Tetrahydrofuran

HCID 76538693HCID 76538693, compound

Product 1

HCID 77172672HCID 77172672, compound

Sources & evidence

ORD record: ord-442db2e905c44745a5a83a6064efeabc
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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