Dichloromethane → HCID 59605285, compound

HRID 686793Notes

Reaction equation

HRID 686793 reaction equation
[CH3:1][C:2]1([CH3:36])[N:3]([CH2:8][c:9]2[n:10]([CH3:35])[c:11]3[n:12][c:13](-[n:24]4[c:25]([CH2:33][CH3:34])[n:26][c:27]5[c:28]4[cH:29][cH:30][cH:31][cH:32]5)[n:14][c:15]([N:18]4[CH2:19][CH2:20][O:21][CH2:22][CH2:23]4)[c:16]3[n:17]2)[CH2:4][CH2:5][NH:6][CH2:7]1.[CH:68]([N:69]([CH2:70][CH3:71])[CH:72]([CH3:73])[CH3:74])([CH3:75])[CH3:76].[Cl:77][CH2:78][Cl:79].[OH:37][C:38]([C:39](=[O:40])[OH:41])([CH3:42])[CH3:43].[P-:44]([F:45])([F:46])([F:47])([F:48])([F:49])[F:50].[n:51]1([O:52][C:53]([N:54]([CH3:55])[CH3:56])=[N+:57]([CH3:58])[CH3:59])[c:60]2[n:61][cH:62][cH:63][cH:64][c:65]2[n:66][n:67]1>>[CH3:1][C:2]1([CH3:36])[N:3]([CH2:8][c:9]2[n:10]([CH3:35])[c:11]3[n:12][c:13](-[n:24]4[c:25]([CH2:33][CH3:34])[n:26][c:27]5[c:28]4[cH:29][cH:30][cH:31][cH:32]5)[n:14][c:15]([N:18]4[CH2:19][CH2:20][O:21][CH2:22][CH2:23]4)[c:16]3[n:17]2)[CH2:4][CH2:5][N:6]([C:39]([C:38]([OH:37])([CH3:42])[CH3:43])=[O:40])[CH2:7]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 116712-Hydroxyisobutyric acidHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 67492830HCID 67492830, compound

Product 1

HCID 59605285HCID 59605285, compound

Sources & evidence

ORD record
ord-e266685e2f534709b74f0b9426269dd4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…