Hydrochloric Acid → Hydrochloric Acid

HRID 1572009Notes

Reaction equation

HRID 1572009 reaction equation
[CH2:28]1[O:29][CH2:30][CH2:31][O:32][CH2:33]1.[CH3:34][OH:35].[Cl:36][CH2:37][Cl:38].[ClH:27].[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[c:10]2[n:11][c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]3[c:18]([NH:20][c:21]3[n:22][nH:23][c:24]([CH3:26])[cH:25]3)[n:19]2)[cH:6][cH:7]1>>[ClH:27].[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([OH:9])[c:10]2[n:11][c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]3[c:18]([NH:20][c:21]3[n:22][nH:23][c:24]([CH3:26])[cH:25]3)[n:19]2)[cH:6][cH:7]1

Participants

7

Reactant 5

HCID 313Hydrochloric AcidHCID 887MethanolHCID 6344DichloromethaneHCID 312751,4-DioxaneHCID 46892243(4-fluorophenyl)(4-(5-methyl-1H-pyrazol-3-ylamino)quinazolin-2-yl)methanone

Product 2

HCID 313Hydrochloric AcidHCID 46892373Ac-430

Sources & evidence

ORD record
ord-34758e6de2df42e88dc7b93467b2425d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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