Acetic Acid → 2-Ethylhexyl 3-(4-aminophenyl)-2-cyanoacrylate

HRID 149248

Reaction equation

HRID 149248 reaction equation
[C:10](#[N:11])[CH2:12][C:13](=[O:14])[O:15][CH2:16][CH:17]([CH2:18][CH2:19][CH2:20][CH3:21])[CH2:22][CH3:23].[CH2:24]([NH:25][CH2:26][CH3:27])[CH3:28].[CH3:29][C:30](=[O:31])[OH:32].[CH:33]([OH:34])([CH3:35])[CH3:36].[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH:6]=[O:7])[cH:8][cH:9]1>>[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH:6]=[C:12]([C:10]#[N:11])[C:13](=[O:14])[O:15][CH2:16][CH:17]([CH2:18][CH2:19][CH2:20][CH3:21])[CH2:22][CH3:23])[cH:8][cH:9]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 3776IsopropanolHCID 8021DiethylamineHCID 111584-AminobenzaldehydeHCID 963592-Ethylhexyl cyanoacetate

Product 1

HCID 538516112-Ethylhexyl 3-(4-aminophenyl)-2-cyanoacrylate

Sources & evidence

ORD record
ord-1194e71db3814070a32fa51d9650094a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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