Hydrochloric Acid → HCID 12557197, compound

HRID 2311401Notes

Reaction equation

HRID 2311401 reaction equation
[C:21](=[O:22])([O-:23])[O-:24].[CH3:1][c:2]1[cH:3][c:4]([NH2:5])[cH:6][cH:7][c:8]1[O:9][c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1.[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[CH3:41][CH2:42][O:43][C:44]([CH3:45])=[O:46].[ClH:16].[Cu:30][C:31]#[N:32].[N:17]([O-:18])=[O:19].[Na+:20].[Na+:25].[Na+:26].[Na:27][C:28]#[N:29].[OH2:33]>>[CH3:1][c:2]1[cH:3][c:4]([C:28]#[N:29])[cH:6][cH:7][c:8]1[O:9][c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1

Participants

11

Reactant 10

HCID 313Hydrochloric AcidHCID 923Sodium ion3×HCID 946NitriteHCID 962WaterHCID 1140TolueneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 155504883-Methyl-4-phenoxyanilineHCID 178418546HCID 178418546, compoundHCID 178511850HCID 178511850, compound

Product 1

HCID 12557197HCID 12557197, compound

Sources & evidence

ORD record
ord-c8b6329b55f0450dba9dc355f823c58d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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