Acetic Acid → HCID 59205691, compound

HRID 1209874Notes

Reaction equation

HRID 1209874 reaction equation
[CH3:36][C:37](=[O:38])[OH:39].[CH3:40][OH:41].[CH:27]([N:28]([CH2:29][CH3:30])[CH:31]([CH3:32])[CH3:33])([CH3:34])[CH3:35].[Cl:1][c:2]1[cH:3][c:4]([CH:5]=[O:6])[cH:7][cH:8][cH:9]1.[ClH:10].[ClH:11].[NH2:12][CH2:13][C:14](=[O:15])[NH:16][c:17]1[cH:18][c:19]2[cH:20][cH:21][n:22][cH:23][c:24]2[cH:25][cH:26]1>>[Cl:1][c:2]1[cH:3][c:4]([CH2:5][NH:12][CH2:13][C:14](=[O:15])[NH:16][c:17]2[cH:18][c:19]3[cH:20][cH:21][n:22][cH:23][c:24]3[cH:25][cH:26]2)[cH:7][cH:8][cH:9]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 313Hydrochloric Acid2×HCID 887MethanolHCID 114773-ChlorobenzaldehydeHCID 81531DiisopropylethylamineHCID 59205721HCID 59205721, compound

Product 1

HCID 59205691HCID 59205691, compound

Sources & evidence

ORD record
ord-26d00743ffe94ca99ec8f1e43c388ec8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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