Hydrochloric Acid → Ethyl 4-(4'-amino-1,1'-biphenyl-4-yl)-4-oxo-2-(2-phenylethyl)butanoate

HRID 163774Notes

Reaction equation

HRID 163774 reaction equation
[CH3:34][CH2:35][OH:36].[ClH:33].[Fe:37].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7](-[c:10]2[cH:11][cH:12][c:13]([C:16]([CH2:17][CH:18]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[CH2:24][CH2:25][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)=[O:32])[cH:14][cH:15]2)[cH:8][cH:9]1>>[NH2:1][c:4]1[cH:5][cH:6][c:7](-[c:10]2[cH:11][cH:12][c:13]([C:16]([CH2:17][CH:18]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[CH2:24][CH2:25][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)=[O:32])[cH:14][cH:15]2)[cH:8][cH:9]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 702EthanolHCID 23925IronHCID 21985737Ethyl 4-(4'-nitro-1,1'-biphenyl-4-yl)-4-oxo-2-(2-phenylethyl)butanoate

Product 1

HCID 21985715Ethyl 4-(4'-amino-1,1'-biphenyl-4-yl)-4-oxo-2-(2-phenylethyl)butanoate

Sources & evidence

ORD record
ord-2eb08e3bf2594da7ab2cf976cf898e14
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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