Benzaldehyde → Ethyl cinnamoylacetate

HRID 1200750Notes

Reaction equation

HRID 1200750 reaction equation
[C:33]([Cl:34])([Cl:35])([Cl:36])[Cl:37].[C:9]([CH2:10][C:11](=[O:12])[CH3:13])(=[O:14])[O:15][CH2:16][CH3:17].[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[CH3:1][N:2]([CH2:3][CH2:4][N:5]([CH3:6])[CH3:7])[CH3:8].[CH:25](=[O:26])[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[Cl-:41].[Cl-:42].[Cl-:43].[Cl-:44].[Cl:38][CH2:39][Cl:40].[OH2:46].[Ti+4:45]>>[C:9]([CH2:10][C:11](=[O:12])[CH:13]=[CH:25][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)(=[O:14])[O:15][CH2:16][CH3:17]

Participants

10

Reactant 9

HCID 240BenzaldehydeHCID 312Chloride4×HCID 962WaterHCID 5943Carbon TetrachlorideHCID 6344DichloromethaneHCID 8037N,N,N',N'-TetramethylethylenediamineHCID 8471TriethylamineHCID 8868Ethyl AcetoacetateHCID 114942Titanium cation (4+)

Product 1

HCID 54004396Ethyl cinnamoylacetate

Sources & evidence

ORD record
ord-adb50d1f33b94261a113519501ea0b12
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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