Benzene → HCID 178476157, compound

HRID 2335153Notes

Reaction equation

HRID 2335153 reaction equation
[C:15]([CH3:16])(=[O:17])[O:18][CH:19]1[CH:20]([NH2:21])[CH:22]([O:23][C:24]([CH3:25])=[O:26])[CH:27]([O:28][C:29]([CH3:30])=[O:31])[CH:32]([CH2:34][O:35][C:36]([CH3:37])=[O:38])[O:33]1.[ClH:39].[I:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][cH:10]1.[S:11]([Cl:12])([Cl:13])=[O:14].[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[cH:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1>>[I:1][c:2]1[cH:3][c:4]([C:5](=[O:7])[NH:21][CH:20]2[CH:19]([O:18][C:15]([CH3:16])=[O:17])[O:33][CH:32]([CH2:34][O:35][C:36]([CH3:37])=[O:38])[CH:27]([O:28][C:29]([CH3:30])=[O:31])[CH:22]2[O:23][C:24]([CH3:25])=[O:26])[cH:8][cH:9][cH:10]1

Participants

7

Reactant 6

HCID 241BenzeneHCID 313Hydrochloric AcidHCID 1049PyridineHCID 120603-Iodobenzoic acidHCID 24386Thionyl ChlorideHCID 408523[3,4,6-Tris(acetyloxy)-5-aminooxan-2-YL]methyl acetate

Product 1

HCID 178476157HCID 178476157, compound

Sources & evidence

ORD record
ord-b92107f1d9414ca69e72d2a6eff954f7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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