Nitric Acid → Methyl 3-nitro-2-(pentanoylamino)benzoate

HRID 1560958Notes

Reaction equation

HRID 1560958 reaction equation
[C:10]([CH2:11][CH2:12][CH2:13][CH3:14])(=[O:15])[NH:16][c:17]1[c:18]([C:19](=[O:20])[O:21][CH3:22])[cH:23][cH:24][cH:25][cH:26]1.[CH3:27][C:28]([O:29][C:30](=[O:31])[CH3:32])=[O:33].[OH:1][N+:2]([O-:3])=[O:4].[S:5](=[O:6])(=[O:7])([OH:8])[OH:9]>>[O-:1][N+:2](=[O:4])[c:26]1[c:17]([NH:16][C:10]([CH2:11][CH2:12][CH2:13][CH3:14])=[O:15])[c:18]([C:19](=[O:20])[O:21][CH3:22])[cH:23][cH:24][cH:25]1

Participants

5

Reactant 4

HCID 944Nitric AcidHCID 1118Sulfuric AcidHCID 7918Acetic AnhydrideHCID 1734908HCID 1734908, compound

Product 1

HCID 15291136Methyl 3-nitro-2-(pentanoylamino)benzoate

Sources & evidence

ORD record
ord-dedb930a9d8f4ef4b570b8d65b3b7921
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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