Hydrochloric Acid → HCID 54244847, compound

HRID 180428Notes

Reaction equation

HRID 180428 reaction equation
[CH3:26][C:27]([OH:28])([CH3:29])[CH3:30].[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[CH:20](=[O:21])[O:22][CH2:23][CH3:24].[ClH:25].[OH2:31].[c:1]1([C:7]2([c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[CH2:8][CH2:9][C:10](=[O:13])[CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]2([c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[CH2:8][CH2:9][C:10](=[O:13])[CH:11]([CH:20]=[O:21])[CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 962WaterHCID 6386tert-ButanolHCID 8025Ethyl formateHCID 8857Ethyl AcetateHCID 1382814,4-Diphenylcyclohexanone

Product 1

HCID 54244847HCID 54244847, compound

Sources & evidence

ORD record
ord-c1654feeb3814103ac0249efad78b41c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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