Acetone → HCID 19822181, compound

HRID 104295Notes

Reaction equation

HRID 104295 reaction equation
[C:2]([CH3:3])(=[O:4])[O:5][c:6]1[c:7]([CH3:32])[c:8]2[c:13]([c:14]([CH3:17])[c:15]1[CH3:16])[O:12][C:11]([CH2:18][CH:19]([CH3:20])[CH3:21])([CH2:22][O:23][c:24]1[cH:25][cH:26][c:27]([NH2:30])[cH:28][cH:29]1)[CH2:10][C:9]2=[O:31].[C:37]([CH:38]=[CH2:39])(=[O:40])[O:41][CH2:42][CH3:43].[CH3:45][C:46](=[O:47])[CH3:48].[ClH:1].[N:33]([O-:34])=[O:35].[Na+:36].[OH2:44]>>[Cl:1][CH:38]([C:37](=[O:40])[O:41][CH2:42][CH3:43])[CH2:39][c:27]1[cH:26][cH:25][c:24]([O:23][CH2:22][C:11]2([CH2:18][CH:19]([CH3:20])[CH3:21])[CH2:10][C:9](=[O:31])[c:8]3[c:7]([CH3:32])[c:6]([O:5][C:2]([CH3:3])=[O:4])[c:15]([CH3:16])[c:14]([CH3:17])[c:13]3[O:12]2)[cH:29][cH:28]1

Participants

8

Reactant 7

HCID 180AcetoneHCID 313Hydrochloric AcidHCID 923Sodium ionHCID 946NitriteHCID 962WaterHCID 8821Ethyl AcrylateHCID 19822264HCID 19822264, compound

Product 1

HCID 19822181HCID 19822181, compound

Sources & evidence

ORD record
ord-8dffd9b13ba048f3aee39834033a063e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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