Isopropanol → Hydrochloric Acid

HRID 139050Notes

Reaction equation

HRID 139050 reaction equation
[CH3:25][CH:26]([OH:27])[CH3:28].[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[cH:8][cH:9][s:10]2.[s:11]1[c:12]([CH2:16][O:17][c:18]2[cH:19][cH:20][c:21]([NH2:22])[cH:23][cH:24]2)[cH:13][cH:14][cH:15]1>>[ClH:1].[c:2]1([NH:22][c:21]2[cH:20][cH:19][c:18]([O:17][CH2:16][c:12]3[s:11][cH:15][cH:14][cH:13]3)[cH:24][cH:23]2)[c:3]2[c:4]([n:5][cH:6][n:7]1)[cH:8][cH:9][s:10]2

Participants

5

Reactant 3

HCID 3776IsopropanolHCID 27358214-Chlorothieno[3,2-d]pyrimidineHCID 221128824-(2-Thienylmethoxy)aniline

Product 2

HCID 313Hydrochloric AcidHCID 22112866N-[4-(thiophen-2-ylmethoxy)phenyl]thieno[3,2-d]pyrimidin-4-amine

Sources & evidence

ORD record
ord-bfdb0ce87f8044b6b774c8e96fc3b9f2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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