Ammonium → Benzene, 1-chloro-4-ethynyl-

HRID 663488Notes

Reaction equation

HRID 663488 reaction equation
[Br-:1].[Br:2][CH2:3][CH2:4][P+:5]([c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1.[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:24][C:25]([CH3:26])([O-:27])[CH3:28].[Cl-:39].[Cl:30][c:31]1[cH:32][cH:33][c:34]([CH:35]=[O:36])[cH:37][cH:38]1.[K+:29].[NH4+:40].[OH2:46]>>[CH:3]#[C:35][c:34]1[cH:33][cH:32][c:31]([Cl:30])[cH:38][cH:37]1

Participants

10

Reactant 9

HCID 223AmmoniumHCID 259Bromide ionHCID 312ChlorideHCID 813Potassium CationHCID 962WaterHCID 77264-ChlorobenzaldehydeHCID 8028TetrahydrofuranHCID 498160HCID 498160, compoundHCID 45749132-Methylpropan-2-olate

Product 1

HCID 70118Benzene, 1-chloro-4-ethynyl-

Sources & evidence

ORD record
ord-de615bd588e94150a2c97fb4ccdb6642
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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