Toluene → HCID 21957919, compound

HRID 1147529Notes

Reaction equation

HRID 1147529 reaction equation
[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([NH:10][CH2:11][c:12]2[cH:13][cH:14][c:15]([O:18][CH2:19][C:20]([F:21])([F:22])[F:23])[cH:16][cH:17]2)[cH:8][cH:9]1.[CH:24]([CH3:25])([CH3:26])[c:27]1[c:28]([N:36]=[C:37]=[O:38])[c:29]([CH:33]([CH3:34])[CH3:35])[cH:30][cH:31][cH:32]1>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([N:10]([CH2:11][c:12]2[cH:13][cH:14][c:15]([O:18][CH2:19][C:20]([F:21])([F:22])[F:23])[cH:16][cH:17]2)[C:37]([NH:36][c:28]2[c:27]([CH:24]([CH3:25])[CH3:26])[cH:32][cH:31][cH:30][c:29]2[CH:33]([CH3:34])[CH3:35])=[O:38])[cH:8][cH:9]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 922592,6-Diisopropylphenyl isocyanateHCID 21957886HCID 21957886, compound

Product 1

HCID 21957919HCID 21957919, compound

Sources & evidence

ORD record
ord-8f5522e4c382460c8ac990aa68924b23
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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