Acetic Acid → 4-(4-Nitrophenyl)oxane

HRID 1121156Notes

Reaction equation

HRID 1121156 reaction equation
[CH3:18][C:19](=[O:20])[OH:21].[OH2:17].[OH:13][N+:14]([O-:15])=[O:16].[c:1]1([CH:7]2[CH2:8][CH2:9][O:10][CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[CH2:8][CH2:9][O:10][CH2:11][CH2:12]2)[cH:2][cH:3][c:4]([N+:14](=[O:13])[O-:15])[cH:5][cH:6]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 944Nitric AcidHCID 962WaterHCID 140726Pyran, 4-phenyltetrahydro-

Product 1

HCID 203654674-(4-Nitrophenyl)oxane

Sources & evidence

ORD record
ord-7c786108bc154a2999261dc47b41048b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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