Benzene → Chloride

HRID 1233894Notes

Reaction equation

HRID 1233894 reaction equation
[Cl:1][CH2:2][c:3]1[c:4]([OH:14])[c:5]([CH:6]=[O:7])[cH:8][c:9]([N+:11](=[O:12])[O-:13])[cH:10]1.[c:15]1([P:21]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[cH:16][cH:17][cH:18][cH:19][cH:20]1.[cH:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[CH2:2]([c:3]1[c:4]([OH:14])[c:5]([CH:6]=[O:7])[cH:8][c:9]([N+:11](=[O:12])[O-:13])[cH:10]1)[P+:21]([c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[Cl-:1]

Participants

5

Reactant 3

HCID 241BenzeneHCID 11776TriphenylphosphineHCID 993803-(Chloromethyl)-2-hydroxy-5-nitrobenzaldehyde

Product 2

HCID 312ChlorideHCID 86747117(3-Formyl-2-hydroxy-5-nitrophenyl)methyl-triphenylphosphanium

Sources & evidence

ORD record
ord-01113db3c68c486f887ab6ab074a1726
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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