Benzene → 4-Nitro-1,1'-biphenyl

HRID 109594

Reaction equation

HRID 109594 reaction equation
[CH3:19][O:20][CH:21]([O:22][CH3:23])[O:24][CH3:25].[Cl-:18].[ClH:36].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([NH2:8])[cH:9][cH:10]1.[N:32]([O-:33])=[O:34].[Na+:35].[OH2:37].[OH:11][C:12]([C:13]([Cl:14])([Cl:15])[Cl:16])=[O:17].[cH:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7](-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:9][cH:10]1

Participants

10

Reactant 9

HCID 241BenzeneHCID 312ChlorideHCID 313Hydrochloric AcidHCID 923Sodium ionHCID 946NitriteHCID 962WaterHCID 6421Trichloroacetic AcidHCID 74754-NitroanilineHCID 9005Trimethyl orthoformate

Product 1

HCID 71144-Nitro-1,1'-biphenyl

Sources & evidence

ORD record
ord-68dd96c969344de9a3107e87490ac9b7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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