Sodium ion → HCID 178424441, compound

HRID 319476Notes

Reaction equation

HRID 319476 reaction equation
[C:13]([OH:14])([CH3:15])([CH3:16])[CH3:17].[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[CH:1]1([c:4]2[c:5]([O-:6])[c:7]([CH3:11])[cH:8][cH:9][cH:10]2)[CH2:2][CH2:3]1.[CH:27]1([c:28]2[cH:29][cH:30][cH:31][c:32]([CH3:33])[c:34]2[OH:35])[CH2:36][CH2:37]1.[Na+:12].[OH2:45].[OH:18][c:19]1[c:20]([Cl:26])[n:21][n:22][c:23]([Cl:25])[cH:24]1>>[CH:1]1([c:4]2[c:5]([O:6][c:20]3[c:19]([OH:18])[cH:24][c:23]([Cl:25])[n:22][n:21]3)[c:7]([CH3:11])[cH:8][cH:9][cH:10]2)[CH2:2][CH2:3]1

Participants

8

Reactant 7

HCID 923Sodium ionHCID 962WaterHCID 1140TolueneHCID 6386tert-ButanolHCID 229399512-Cyclopropyl-6-methylphenolHCID 178424439HCID 178424439, compoundHCID 178516198HCID 178516198, compound

Product 1

HCID 178424441HCID 178424441, compound

Sources & evidence

ORD record
ord-2f3850c5f7bd453f93a24fe15319ef94
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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