Toluene → HCID 178438797, compound

HRID 118394Notes

Reaction equation

HRID 118394 reaction equation
[CH3:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1.[O:1]=[C:2]([O:3][CH2:4][CH3:5])[N:6]=[N:7][C:8]([O:9][CH2:10][CH3:11])=[O:12].[O:64]1[CH2:65][CH2:66][CH2:67][CH2:68]1.[OH:20][CH2:21][CH:22]([CH:23]1[O:24][C:25](=[O:31])[CH:26]([CH2:28][CH2:29][CH3:30])[CH2:27]1)[NH:32][S:33](=[O:34])(=[O:35])[c:36]1[c:37]([N+:42](=[O:43])[O-:44])[cH:38][cH:39][cH:40][cH:41]1.[c:45]1([P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[cH:59][cH:60][cH:61][cH:62][cH:63]1>>[CH2:21]1[CH:22]([CH:23]2[O:24][C:25](=[O:31])[CH:26]([CH2:28][CH2:29][CH3:30])[CH2:27]2)[N:32]1[S:33](=[O:34])(=[O:35])[c:36]1[c:37]([N+:42](=[O:43])[O-:44])[cH:38][cH:39][cH:40][cH:41]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 220568ethyl N-ethoxycarbonyliminocarbamateHCID 178439182HCID 178439182, compound

Product 1

HCID 178438797HCID 178438797, compound

Sources & evidence

ORD record
ord-7168a3ffaf7e410f91c17625da445944
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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