Acetic Acid → Methyl 5-methoxy-4-(4-chlorobutoxy)-2-nitrobenzoate

HRID 173025Notes

Reaction equation

HRID 173025 reaction equation
[CH3:23][C:24](=[O:25])[OH:26].[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][O:6][c:7]1[c:8]([O:17][CH3:18])[cH:9][c:10]([C:11](=[O:12])[O:13][CH3:14])[cH:15][cH:16]1.[N:19](=[O:20])[O-:21].[Na+:22].[OH2:31].[OH:27][N+:28](=[O:29])[O-:30]>>[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][O:6][c:7]1[c:8]([O:17][CH3:18])[cH:9][c:10]([C:11](=[O:12])[O:13][CH3:14])[c:15]([N+:19](=[O:20])[O-:21])[cH:16]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 923Sodium ionHCID 944Nitric AcidHCID 946NitriteHCID 962WaterHCID 10192903HCID 10192903, compound

Product 1

HCID 10215101Methyl 5-methoxy-4-(4-chlorobutoxy)-2-nitrobenzoate

Sources & evidence

ORD record
ord-9f012352b1c447deaca9929e7ca4dbe6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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