Acetic Acid → HCID 68829834, compound

HRID 306485Notes

Reaction equation

HRID 306485 reaction equation
[CH3:43][C:44](=[O:45])[OH:46].[CH:35](=[O:36])[c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[Cl:47][CH2:48][Cl:49].[F:1][c:2]1[c:3](-[c:9]2[n:10][n:11][n:12]([CH:14]3[CH2:15][CH:16]([C:19](=[O:20])[N:21]4[CH2:22][CH2:23][N:24]([c:27]5[c:28]([C:29]#[N:30])[cH:31][cH:32][cH:33][cH:34]5)[CH2:25][CH2:26]4)[NH:17][CH2:18]3)[n:13]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1>>[F:1][c:2]1[c:3](-[c:9]2[n:10][n:11][n:12]([CH:14]3[CH2:15][CH:16]([C:19](=[O:20])[N:21]4[CH2:22][CH2:23][N:24]([c:27]5[c:28]([C:29]#[N:30])[cH:31][cH:32][cH:33][cH:34]5)[CH2:25][CH2:26]4)[N:17]([CH2:35][c:37]4[cH:38][cH:39][cH:40][cH:41][cH:42]4)[CH2:18]3)[n:13]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 240BenzaldehydeHCID 6344DichloromethaneHCID 66916032HCID 66916032, compound

Product 1

HCID 68829834HCID 68829834, compound

Sources & evidence

ORD record
ord-395e10f264474cc089b3f5a3fe676695
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…