Toluene → Bromide ion

HRID 1202894Notes

Reaction equation

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([NH:13][C:14]([CH2:15][CH:16]2[c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]3[O:23][c:24]3[cH:25][cH:26][cH:27][cH:28][c:29]32)=[O:30])[cH:7][c:8]([CH2:11][Br:12])[cH:9][cH:10]1.[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[c:31]1([P:37]([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[Br-:12].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([NH:13][C:14]([CH2:15][CH:16]2[c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]3[O:23][c:24]3[cH:25][cH:26][cH:27][cH:28][c:29]32)=[O:30])[cH:7][c:8]([CH2:11][P+:37]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[cH:9][cH:10]1

Participants

Reactant 3

HCID 1140Toluene

HCID 11776Triphenylphosphine

HCID 19966210HCID 19966210, compound

Product 2

HCID 259Bromide ion

HCID 19966089HCID 19966089, compound

Sources & evidence

ORD record: ord-7e262f6fd00846d5857d4b06be54469e
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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