Ammonia → HCID 12681766, compound

HRID 697618Notes

Reaction equation

HRID 697618 reaction equation
[Br:1][c:2]1[cH:3][c:4]([OH:8])[cH:5][cH:6][cH:7]1.[C:29](#[N:30])[C:31]1([N:38]([CH3:39])[CH3:40])[CH2:32][CH2:33][C:34](=[O:37])[CH2:35][CH2:36]1.[CH2:27]=[CH2:28].[CH3:50][CH2:51][O:52][CH2:53][CH3:54].[CH3:59][OH:60].[CH:55]([Cl:56])([Cl:57])[Cl:58].[Cl-:41].[ClH:43].[Mg:26].[NH3:44].[NH4+:42].[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[O:9]1[CH:10]=[CH:11][CH2:12][CH2:13][CH2:14]1.[c:15]1([CH3:16])[cH:17][cH:18][c:19]([S:20]([OH:21])(=[O:22])=[O:23])[cH:24][cH:25]1.[cH:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1>>[c:2]1([C:31]2([N:38]([CH3:39])[CH3:40])[CH2:32][CH2:33][C:34](=[O:37])[CH2:35][CH2:36]2)[cH:3][c:4]([OH:8])[cH:5][cH:6][cH:7]1

Participants

16

Reactant 15

HCID 222AmmoniaHCID 223AmmoniumHCID 241BenzeneHCID 312ChlorideHCID 313Hydrochloric AcidHCID 887MethanolHCID 3283Diethyl EtherHCID 6101p-Toluenesulfonic acidHCID 6212ChloroformHCID 6325EthyleneHCID 8028TetrahydrofuranHCID 80803,4-dihydro-2H-pyranHCID 115633-BromophenolHCID 5462224MagnesiumHCID 20453329HCID 20453329, compound

Product 1

HCID 12681766HCID 12681766, compound

Sources & evidence

ORD record
ord-6d67bb670bb14a4fbe5d5cc181d975dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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