Benzene → HCID 21412626, compound

HRID 205365Notes

Reaction equation

HRID 205365 reaction equation
[CH3:38][I:39].[ClH:40].[H-:36].[Na+:37].[OH:19][CH2:20][c:21]1[cH:22][c:23]2[c:24]([cH:25][cH:26]1)[cH:27][c:28]([CH:29]([CH3:30])[C:31]([OH:32])=[O:33])[cH:34][cH:35]2.[OH:1][CH2:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8]([CH:13]([C:14](=[O:15])[O:16][CH3:17])[CH3:18])[cH:9][c:10]2[cH:11][cH:12]1.[cH:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1>>[O:1]([CH2:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8]([CH:13]([C:14](=[O:15])[O:16][CH3:17])[CH3:18])[cH:9][c:10]2[cH:11][cH:12]1)[CH3:20]

Participants

8

Reactant 7

HCID 241BenzeneHCID 313Hydrochloric AcidHCID 923Sodium ionHCID 6328Methyl iodideHCID 166653HydrideHCID 20335004HCID 20335004, compoundHCID 21412644HCID 21412644, compound

Product 1

HCID 21412626HCID 21412626, compound

Sources & evidence

ORD record
ord-df7c5c036b9845ec87d0f6bd1433592d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…