Benzene → HCID 21541758, compound

HRID 1116408Notes

Reaction equation

HRID 1116408 reaction equation
[CH3:17][NH2:18].[Cl-:19].[Cl-:20].[Cl-:21].[Cl-:22].[Ti+4:23].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:6](=[O:16])[c:7]3[c:8]([cH:9][cH:10][c:11]12)[cH:12][cH:13][cH:14][cH:15]3.[cH:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:6](=[N:18][CH3:17])[c:7]3[c:8]([cH:9][cH:10][c:11]12)[cH:12][cH:13][cH:14][cH:15]3

Participants

6

Reactant 5

HCID 241BenzeneHCID 312Chloride4×HCID 6329MethylamineHCID 166795H-Dibenzo[a,d]cyclohepten-5-oneHCID 114942Titanium cation (4+)

Product 1

HCID 21541758HCID 21541758, compound

Sources & evidence

ORD record
ord-20b68874e1074160a51c1771e18d542d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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