Dichloromethane → HCID 59146043, compound

HRID 137832Notes

Reaction equation

HRID 137832 reaction equation
[CH:62]([N:63]([CH2:64][CH3:65])[CH:66]([CH3:67])[CH3:68])([CH3:69])[CH3:70].[Cl:1][c:2]1[cH:3][c:4](-[c:12]2[n:13][c:14](-[c:17]3[cH:18][cH:19][cH:20][c:21]4[c:22]([CH2:26][CH2:27][C:28](=[O:29])[OH:30])[cH:23][nH:24][c:25]34)[n:15][o:16]2)[cH:5][cH:6][c:7]1[O:8][CH:9]([CH3:10])[CH3:11].[Cl:71][CH2:72][Cl:73].[NH2:31][CH2:32][C:33](=[O:34])[O:35][CH2:36][CH3:37].[P-:38]([F:39])([F:40])([F:41])([F:42])([F:43])[F:44].[n:45]1([O:46][C:47]([N:48]([CH3:49])[CH3:50])=[N+:51]([CH3:52])[CH3:53])[c:54]2[n:55][cH:56][cH:57][cH:58][c:59]2[n:60][n:61]1>>[Cl:1][c:2]1[cH:3][c:4](-[c:12]2[n:13][c:14](-[c:17]3[cH:18][cH:19][cH:20][c:21]4[c:22]([CH2:26][CH2:27][C:28](=[O:29])[NH:31][CH2:32][C:33](=[O:34])[O:35][CH2:36][CH3:37])[cH:23][nH:24][c:25]34)[n:15][o:16]2)[cH:5][cH:6][c:7]1[O:8][CH:9]([CH3:10])[CH3:11]

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 12176Glycine ethyl esterHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 44547315HCID 44547315, compound

Product 1

HCID 59146043HCID 59146043, compound

Sources & evidence

ORD record
ord-f30c09d357214476bb9a8602772dff75
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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