Chloride → HCID 54088045, compound

HRID 156613Notes

Reaction equation

HRID 156613 reaction equation
[CH3:57][CH2:58][CH2:59][CH2:60][CH2:61][CH2:62][CH3:63].[CH3:64][S:65](=[O:66])[CH3:67].[CH:4]1([C:7](=[CH:8][CH2:9][P+:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:29]2[cH:30][cH:31][c:32]([O:35][C:36]([F:37])([F:38])[F:39])[cH:33][cH:34]2)[CH2:5][CH2:6]1.[Cl-:3].[ClH:56].[F:40][c:41]1[c:42]([O:49][c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[cH:43][c:44]([CH:45]=[O:46])[cH:47][cH:48]1.[H-:1].[Na+:2]>>[CH:4]1([C:7](=[CH:8][CH:9]=[CH:45][c:44]2[cH:43][c:42]([O:49][c:50]3[cH:51][cH:52][cH:53][cH:54][cH:55]3)[c:41]([F:40])[cH:48][cH:47]2)[c:29]2[cH:30][cH:31][c:32]([O:35][C:36]([F:37])([F:38])[F:39])[cH:33][cH:34]2)[CH2:5][CH2:6]1

Participants

9

Reactant 8

HCID 312ChlorideHCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 923Sodium ionHCID 8900HeptaneHCID 1100684-Fluoro-3-phenoxybenzaldehydeHCID 166653HydrideHCID 86744368HCID 86744368, compound

Product 1

HCID 54088045HCID 54088045, compound

Sources & evidence

ORD record
ord-3328d42bd796403a958ed788d2a09382
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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