Methylamine → 3-Methyl-1-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea

Reaction equation

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

Participants

Reactant 3

HCID 6329Methylamine

HCID 8028Tetrahydrofuran2×

HCID 27734742-(4-Isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Product 1

HCID 177502733-Methyl-1-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea

Sources & evidence

ORD record: ord-675710947ceb4ef3b03068816ce4d951
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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