2-Ethylphenol → HCID 21895261, compound

HRID 2127785Notes

Reaction equation

HRID 2127785 reaction equation
[CH2:35]([CH3:36])[c:37]1[c:38]([OH:43])[cH:39][cH:40][cH:41][cH:42]1.[O:44]=[C:45]([O:46][CH2:47][CH3:48])[N:49]=[N:50][C:51]([O:52][CH2:53][CH3:54])=[O:55].[O:56]1[CH2:57][CH2:58][CH2:59][CH2:60]1.[OH:1][CH2:2][CH:3]([CH3:4])[N:5]1[C:6](=[O:15])[c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]2[C:13]1=[O:14].[c:16]1([P:17]([c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[O:1]([CH2:2][CH:3]([CH3:4])[N:5]1[C:6](=[O:15])[c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]2[C:13]1=[O:14])[c:38]1[c:37]([CH2:35][CH3:36])[cH:42][cH:41][cH:40][cH:39]1

Participants

6

Reactant 5

HCID 69972-EthylphenolHCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 220568ethyl N-ethoxycarbonyliminocarbamateHCID 6000202-(2-Hydroxy-1-methylethyl)-1H-isoindole-1,3(2H)-dione

Product 1

HCID 21895261HCID 21895261, compound

Sources & evidence

ORD record
ord-6e39fe031e144bca82661d0886d97bce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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