Potassium Cation → HCID 4861010, compound

HRID 698212Notes

Reaction equation

HRID 698212 reaction equation
[C:33](=[O:34])([O-:35])[O-:36].[CH2:39]1[O:40][CH2:41][CH2:42][O:43][CH2:44]1.[Cu:45][I:46].[F:12][C:13]([c:14]1[n:15][nH:16][c:17]2[c:22]1[CH2:21][CH2:20][CH2:19][CH2:18]2)([F:23])[F:24].[I:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1.[K+:37].[K+:38].[NH2:25][CH:26]1[CH2:27][CH2:28][CH2:29][CH2:30][CH:31]1[NH2:32]>>[c:2]1(-[n:16]2[n:15][c:14]([C:13]([F:12])([F:23])[F:24])[c:22]3[c:17]2[CH2:18][CH2:19][CH2:20][CH2:21]3)[cH:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 46101,2-DiaminocyclohexaneHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 312751,4-DioxaneHCID 69273Methyl 4-iodobenzoateHCID 28028633-(Trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole

Product 1

HCID 4861010HCID 4861010, compound

Sources & evidence

ORD record
ord-fd817e8f67464eb0ae0f1965d0b5fd87
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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