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Benzene → Acetic acid, 2-(triphenylphosphoranylidene)-, methyl ester

HRID 92858
Notes
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Reaction equation

HRID 92858 reaction equation
[Br-:26].[Br:20][CH2:21][C:22]([O:23][CH3:24])=[O:25].[CH3:27][O:28][C:29](=[O:30])[CH2:31][P+:32]([c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)([c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[Na+:53].[OH-:52].[OH2:60].[PH4+:51].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1.[cH:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1>>[CH3:27][O:28][C:29](=[O:30])[CH:31]=[P:32]([c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)([c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1
ParticipantsSources & evidenceReaction notes

Participants

10

Reactant 9

HCID 241BenzeneHCID 259Bromide ionHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 11776TriphenylphosphineHCID 60984Methyl bromoacetate
HCID 494138
(2-Methoxy-2-oxoethyl)triphenylphosphonium bromide
HCID 5460504Phosphonium

Product 1

HCID 17453Acetic acid, 2-(triphenylphosphoranylidene)-, methyl ester

Sources & evidence

ORD record
ord-6b91fad7975244fea6239dd71cc6c641
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes