Toluene → HCID 67263320, compound

HRID 2159114Notes

Reaction equation

[CH3:22][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[Cu:34][I:35].[NH2:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][c:12]1[Br:13].[O:29]1[CH2:30][CH2:31][CH2:32][CH2:33]1.[c:14]1([C:20]#[CH:21])[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[NH2:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][c:12]1[C:21]#[C:20][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1

Participants

Reactant 6

HCID 1140Toluene

HCID 8028Tetrahydrofuran

HCID 8471Triethylamine

HCID 10821Phenylacetylene

HCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

HCID 7210833Ethyl 6-amino-5-bromonicotinate

Product 1

HCID 67263320HCID 67263320, compound

Sources & evidence

ORD record: ord-5437d44da53841e8bd4067c881ff632f
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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