Acetate → HCID 57460379, compound

HRID 2153146Notes

Reaction equation

HRID 2153146 reaction equation
[C:62]([O-:63])(=[O:64])[CH3:65].[C:67]([O-:68])(=[O:69])[CH3:70].[CH3:28][C:29]1([CH3:42])[O:30][c:31]2[cH:32][cH:33][c:34]([B:39]([OH:40])[OH:41])[cH:35][c:36]2[CH2:37][CH2:38]1.[CH3:49][CH2:50][N:51]([CH2:52][CH3:53])[CH2:54][CH3:55].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[Cl:71][CH2:72][Cl:73].[Cu+2:66].[F:1][c:2]1[cH:3][c:4](-[c:20]2[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]2)[cH:5][cH:6][c:7]1[CH2:8][c:9]1[c:10]([CH2:17][CH2:18][CH3:19])[n:11][c:12]([CH3:16])[nH:13][c:14]1=[O:15].[cH:43]1[cH:44][cH:45][n:46][cH:47][cH:48]1>>[F:1][c:2]1[cH:3][c:4](-[c:20]2[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]2)[cH:5][cH:6][c:7]1[CH2:8][c:9]1[c:10]([CH2:17][CH2:18][CH3:19])[n:11][c:12]([CH3:16])[n:13](-[c:34]2[cH:33][cH:32][c:31]3[c:36]([cH:35]2)[CH2:37][CH2:38][C:29]([CH3:28])([CH3:42])[O:30]3)[c:14]1=[O:15]

Participants

9

Reactant 8

HCID 175Acetate2×HCID 1049PyridineHCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 27099Cupric cationHCID 23005346B-(3,4-Dihydro-2,2-dimethyl-2H-1-benzopyran-6-yl)boronic acidHCID 1360269433'-Fluoro-4'-[(2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl)methyl]biphenyl-2-carbonitrile

Product 1

HCID 57460379HCID 57460379, compound

Sources & evidence

ORD record
ord-3cd24c9413854e8898ec2e833f6f6c99
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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