Acetonitrile → HCID 9842334, compound

HRID 2332585Notes

Reaction equation

HRID 2332585 reaction equation
[CH3:45][C:46]#[N:47].[CH:37]1([CH2:38][OH:39])[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44]1.[NH2:1][c:2]1[n:3][c:4]([N:18]([CH2:19][c:20]2[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]2)[CH2:28][c:29]2[cH:30][cH:31][c:32]([O:33][CH3:34])[cH:35][cH:36]2)[c:5]([CH:16]=[O:17])[c:6]([O:8][CH2:9][CH:10]2[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]2)[n:7]1.[OH:48][C:49]([C:50]([F:51])([F:52])[F:53])=[O:54]>>[NH2:1][c:2]1[n:3][c:4]([NH:18][CH2:19][c:20]2[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]2)[c:5]([CH:16]=[O:17])[c:6]([O:8][CH2:9][CH:10]2[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]2)[n:7]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 6422Trifluoroacetic acidHCID 7507CyclohexanemethanolHCID 12986176HCID 12986176, compound

Product 1

HCID 9842334HCID 9842334, compound

Sources & evidence

ORD record
ord-16b84b87ae094e1fb411e580c1a06f58
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…