Hydrochloric Acid → HCID 178496294, compound

HRID 1128787Notes

Reaction equation

HRID 1128787 reaction equation
[C:51](=[O:52])([O-:53])[O-:54].[C:59](=[O:60])([O-:61])[OH:62].[CH3:64][N:65]([CH3:66])[CH:67]=[O:68].[Cl:39][CH2:40][CH2:41][N:42]1[CH:43]([CH2:48][O:49][CH3:50])[CH2:44][O:45][CH2:46][CH2:47]1.[ClH:38].[F:1][C:2]([c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH:9]([CH2:14][c:15]3[cH:16][c:17]([O:22][CH2:23][O:24][CH2:25][CH2:26][O:27][CH3:28])[c:18]([CH3:21])[cH:19][cH:20]3)[CH2:10][NH:11][CH2:12][CH2:13]2)[cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]1)([F:36])[F:37].[I-:58].[K+:55].[K+:56].[K+:57].[Na+:63]>>[F:1][C:2]([c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH:9]([CH2:14][c:15]3[cH:16][c:17]([O:22][CH2:23][O:24][CH2:25][CH2:26][O:27][CH3:28])[c:18]([CH3:21])[cH:19][cH:20]3)[CH2:10][N:11]([CH2:40][CH2:41][N:42]3[CH:43]([CH2:48][O:49][CH3:50])[CH2:44][O:45][CH2:46][CH2:47]3)[CH2:12][CH2:13]2)[cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]1)([F:36])[F:37]

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 813Potassium Cation3×HCID 923Sodium ionHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 30165Iodide IonHCID 178510564-(2-Chloroethyl)-3-(methoxymethyl)morpholineHCID 179639311-[3,5-Bis(trifluoromethyl)benzoyl]-2-[3-[(2-methoxyethoxy)methoxy]-4-methylbenzyl]piperazine

Product 1

HCID 178496294HCID 178496294, compound

Sources & evidence

ORD record
ord-2ae03078567a43c29bf62c78677ac8dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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