Hydrochloric Acid → Hydrochloric Acid

HRID 1202902Notes

Reaction equation

HRID 1202902 reaction equation
[CH2:49]([O:50][CH2:51][CH3:52])[CH3:53].[CH2:54]([OH:55])[CH3:56].[CH3:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[CH3:57][N:58]([CH3:59])[CH:60]=[O:61].[CH:45]([Cl:46])([Cl:47])[Cl:48].[ClH:44].[OH-:33].[OH:1][c:2]1[c:3]([O:24][CH3:25])[cH:4][c:5]2[c:14]3[c:13]1-[c:12]1[c:11]([cH:18][c:17]([O:19][CH3:20])[c:16]([O:21][CH3:22])[cH:15]1)[CH2:10][CH:9]3[CH2:8][N:7]([CH3:23])[CH2:6]2.[c:34]1([N+:35]([CH3:36])([CH3:37])[CH3:38])[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[ClH:44].[O:1]([c:2]1[c:3]([O:24][CH3:25])[cH:4][c:5]2[c:14]3[c:13]1-[c:12]1[c:11]([cH:18][c:17]([O:19][CH3:20])[c:16]([O:21][CH3:22])[cH:15]1)[CH2:10][CH:9]3[CH2:8][N:7]([CH3:23])[CH2:6]2)[CH3:26]

Participants

11

Reactant 9

HCID 313Hydrochloric AcidHCID 702EthanolHCID 961HydroxideHCID 1140TolueneHCID 3283Diethyl EtherHCID 6212ChloroformHCID 6228DimethylformamideHCID 15914PhenyltrimethylammoniumHCID 128020804,5,15-Trimethoxy-11-methyl-11-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,13,15-hexaen-16-ol

Product 2

HCID 313Hydrochloric AcidHCID 12802084(+/-)-5,6,6a,7-tetrahydro-1,2,9,10-tetramethoxy-5-methyl-4H-dibenz(de,g)isoquinoline

Sources & evidence

ORD record
ord-c1180b6c16964680ac1e4ff9b30a697e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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