1-Butanol → HCID 178450729, compound

HRID 116647

Reaction equation

HRID 116647 reaction equation
[CH2:26]([OH:27])[CH2:28][CH2:29][CH3:30].[Cl:1][c:2]1[n:3][c:4]([Cl:11])[c:5]2[nH:6][cH:7][n:8][c:9]2[n:10]1.[NH2:12][c:13]1[cH:14][cH:15][c:16]([C:17](=[O:18])[O:19][CH2:20][CH2:21][CH2:22][CH3:23])[cH:24][cH:25]1>>[Cl:1][c:2]1[n:3][c:4]([NH:12][c:13]2[cH:14][cH:15][c:16]([C:17](=[O:18])[O:19][CH2:20][CH2:21][CH2:22][CH3:23])[cH:24][cH:25]2)[c:5]2[n:6][cH:7][nH:8][c:9]2[n:10]1

Participants

4

Reactant 3

HCID 2631-ButanolHCID 2482Butyl 4-aminobenzoateHCID 53244122,6-Dichloropurine

Product 1

HCID 178450729HCID 178450729, compound

Sources & evidence

ORD record
ord-e3013f38d38f4fffba7767169d9b5ef9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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