Toluene → HCID 178470655, compound

HRID 134188Notes

Reaction equation

HRID 134188 reaction equation
[C:1](=[O:2])([O:3][CH2:4][CH3:5])[CH:6]=[P:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[CH3:54][c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1.[F:26][c:27]1[c:28]([CH:34]2[CH:35]([NH:46][C:47]([O:48][C:49]([CH3:50])([CH3:51])[CH3:52])=[O:53])[c:36]3[c:37]([n:38][cH:39][cH:40][cH:41]3)[C:42](=[O:45])[CH2:43][CH2:44]2)[cH:29][cH:30][cH:31][c:32]1[F:33]>>[C:1](=[O:2])([O:3][CH2:4][CH3:5])[CH:6]=[C:42]1[c:37]2[c:36]([cH:41][cH:40][cH:39][n:38]2)[CH:35]([NH:46][C:47]([O:48][C:49]([CH3:50])([CH3:51])[CH3:52])=[O:53])[CH:34]([c:28]2[c:27]([F:26])[c:32]([F:33])[cH:31][cH:30][cH:29]2)[CH2:44][CH2:43]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 70670Acetic acid, 2-(triphenylphosphoranylidene)-, ethyl esterHCID 178452613HCID 178452613, compound

Product 1

HCID 178470655HCID 178470655, compound

Sources & evidence

ORD record
ord-a4bf34725a664369ae0882bbfd8ca530
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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