Hydrochloric Acid → Morpholino(3-nitrophenyl)methanone

HRID 2326175Notes

Reaction equation

HRID 2326175 reaction equation
[C:46](=[O:47])([OH:48])[O-:49].[CH2:13]1[CH2:14][O:15][CH2:16][CH2:17][NH:18]1.[CH3:20][N:21]([CH3:22])[CH2:23][CH2:24][CH2:25][N:26]=[C:27]=[N:28][CH2:29][CH3:30].[ClH:19].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][cH:12]1.[Na+:50].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1.[OH:31][n:32]1[c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2[n:39][n:40]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([C:7](=[O:9])[N:18]2[CH2:13][CH2:14][O:15][CH2:16][CH2:17]2)[cH:10][cH:11][cH:12]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 8083MorpholineHCID 84973-Nitrobenzoic acidHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-Hydroxybenzotriazole

Product 1

HCID 225453Morpholino(3-nitrophenyl)methanone

Sources & evidence

ORD record
ord-d33dbcf2d8c9448882081734bd693518
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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