Dichloromethane → HCID 68652968, compound

HRID 1570836Notes

Reaction equation

HRID 1570836 reaction equation
[C:1]([CH3:3])([CH3:4])([O:5][C:6](=[O:2])[N:8]1[CH:9]([CH2:23][N:24]2[CH2:25][CH2:26][O:27][CH2:28][CH2:29]2)[CH2:10][N:11]([c:14]2[cH:15][c:16]([O:21][CH3:22])[c:17]([Cl:20])[cH:18][cH:19]2)[CH2:12][CH2:13]1)[CH3:7].[CH:45]([N:46]([CH2:47][CH3:48])[CH:49]([CH3:50])[CH3:51])([CH3:52])[CH3:53].[Cl:30][c:31]1[c:32]([C:41]([F:42])([F:43])[F:44])[n:33][n:34]([CH2:37][C:38]([OH:39])=[O:40])[c:35]1[CH3:36].[Cl:78][CH2:79][Cl:80].[OH:81][C:82]([C:83]([F:84])([F:85])[F:86])=[O:87].[P-:54]([F:55])([F:56])([F:57])([F:58])([F:59])[F:60].[n:61]1([O:62][C:63]([N:64]([CH3:65])[CH3:66])=[N+:67]([CH3:68])[CH3:69])[c:70]2[n:71][cH:72][cH:73][cH:74][c:75]2[n:76][n:77]1>>[O:5]=[C:6]([N:8]1[CH:9]([CH2:23][N:24]2[CH2:25][CH2:26][O:27][CH2:28][CH2:29]2)[CH2:10][N:11]([c:14]2[cH:15][c:16]([O:21][CH3:22])[c:17]([Cl:20])[cH:18][cH:19]2)[CH2:12][CH2:13]1)[CH2:37][n:34]1[n:33][c:32]([C:41]([F:42])([F:43])[F:44])[c:31]([Cl:30])[c:35]1[CH3:36]

Participants

8

Reactant 7

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 1876853(4-Chloro-5-methyl-3-trifluoromethyl-pyrazol-1-yl)-acetic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 68653208HCID 68653208, compound

Product 1

HCID 68652968HCID 68652968, compound

Sources & evidence

ORD record
ord-3979c2ce83654077aacbba4d063d9e52
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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