Benzene → HCID 19822253, compound

HRID 1203139Notes

Reaction equation

HRID 1203139 reaction equation
[CH3:1][C:2](=[O:3])[O:4][C:5](=[O:6])[CH3:7].[OH2:53].[OH:8][c:9]1[c:10]([CH3:40])[c:11]2[c:16]([c:17]([CH3:20])[c:18]1[CH3:19])[O:15][C:14]([CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28])([CH2:29][O:30][c:31]1[cH:32][cH:33][c:34]([N+:37](=[O:38])[O-:39])[cH:35][cH:36]1)[CH2:13][CH2:12]2.[cH:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1.[cH:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[CH3:1][C:2](=[O:3])[O:8][c:9]1[c:10]([CH3:40])[c:11]2[c:16]([c:17]([CH3:20])[c:18]1[CH3:19])[O:15][C:14]([CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28])([CH2:29][O:30][c:31]1[cH:32][cH:33][c:34]([N+:37](=[O:38])[O-:39])[cH:35][cH:36]1)[CH2:13][CH2:12]2

Participants

6

Reactant 5

HCID 241BenzeneHCID 962WaterHCID 1049PyridineHCID 7918Acetic AnhydrideHCID 19822242HCID 19822242, compound

Product 1

HCID 19822253HCID 19822253, compound

Sources & evidence

ORD record
ord-5ca8ac87b2b0426c852d102abdda1dca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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