Acetic Acid → HCID 23468914, compound

HRID 163345Notes

Reaction equation

HRID 163345 reaction equation
[CH3:1][c:2]1[o:3][c:4]2[c:5]([c:6]1[CH3:7])[cH:8][cH:9][c:10]([CH:12]1[CH2:13][C:14](=[O:15])[O:16][C:17](=[O:19])[CH2:18]1)[cH:11]2.[CH3:20][NH2:21].[CH3:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[CH3:30][C:31](=[O:32])[OH:33].[OH2:22]>>[CH3:1][c:2]1[o:3][c:4]2[c:5]([c:6]1[CH3:7])[cH:8][cH:9][c:10]([CH:12]1[CH2:13][C:14](=[O:15])[N:21]([CH3:20])[C:17](=[O:19])[CH2:18]1)[cH:11]2

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 962WaterHCID 1140TolueneHCID 6329MethylamineHCID 53815846HCID 53815846, compound

Product 1

HCID 23468914HCID 23468914, compound

Sources & evidence

ORD record
ord-39648a108ab14e939bd6165cd53b7fd5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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