Water → HCID 86585103, compound

HRID 1117498Notes

Reaction equation

HRID 1117498 reaction equation
[CH2:1]([CH3:2])[O:3][P:4]([O:5][CH2:6][CH3:7])(=[O:8])[c:9]1[cH:10][c:11](-[c:15]2[cH:16][cH:17][c:18]([CH2:21][C:22]([n:23]3[c:24]4[cH:25][cH:26][cH:27][cH:28][c:29]4[n:30][n:31]3)([c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[CH2:38][c:39]3[cH:40][cH:41][c:42]([C:43]([F:44])([F:45])[P:46]([OH:47])([OH:48])=[O:49])[cH:50][cH:51]3)[cH:19][cH:20]2)[cH:12][cH:13][cH:14]1.[CH3:52][CH2:53][O:54][C:55]([CH3:56])=[O:57].[Cl:59][CH:60]([Cl:61])[Cl:62].[O:63]=[CH:64][N:65]([CH3:66])[CH3:67].[OH2:58]>>[CH2:1]([CH3:2])[O:3][P:4]([O:5][CH2:6][CH3:7])(=[O:8])[c:9]1[cH:10][c:11](-[c:15]2[cH:16][cH:17][c:18]([CH2:21][Cl:59])[cH:19][cH:20]2)[cH:12][cH:13][cH:14]1

Participants

6

Reactant 5

HCID 962WaterHCID 6212ChloroformHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 59892054HCID 59892054, compound

Product 1

HCID 86585103HCID 86585103, compound

Sources & evidence

ORD record
ord-a34337d8d87c4228a8838d2b84f491d9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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