1-Butanol → HCID 178491022, compound

HRID 121004Notes

Reaction equation

HRID 121004 reaction equation
[CH2:46]([OH:47])[CH2:48][CH2:49][CH3:50].[CH3:25][O:26][c:27]1[c:28]([CH2:35][NH2:36])[cH:29][cH:30][c:31]([O:33][CH3:34])[cH:32]1.[CH:37]([N:38]([CH2:39][CH3:40])[CH:41]([CH3:42])[CH3:43])([CH3:44])[CH3:45].[N:1](=[N+:2]=[N-:3])[CH2:4][CH:5]1[CH2:6][CH:7]([n:15]2[c:16]3[n:17][cH:18][n:19][c:20]([Cl:24])[c:21]3[n:22][cH:23]2)[CH:8]2[CH:9]1[O:10][C:11]([CH3:13])([CH3:14])[O:12]2>>[N:1](=[N+:2]=[N-:3])[CH2:4][CH:5]1[CH2:6][CH:7]([n:15]2[c:16]3[n:17][cH:18][n:19][c:20]([NH:36][CH2:35][c:28]4[c:27]([O:26][CH3:25])[cH:32][c:31]([O:33][CH3:34])[cH:30][cH:29]4)[c:21]3[n:22][cH:23]2)[CH:8]2[CH:9]1[O:10][C:11]([CH3:13])([CH3:14])[O:12]2

Participants

5

Reactant 4

HCID 2631-ButanolHCID 81531DiisopropylethylamineHCID 5972502,4-DimethoxybenzylamineHCID 123655603HCID 123655603, compound

Product 1

HCID 178491022HCID 178491022, compound

Sources & evidence

ORD record
ord-e7fae833e6a742f682337db64fb5ca91
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…