1-Butanol → Hydrochloric Acid

HRID 97963Notes

Reaction equation

HRID 97963 reaction equation
[CH2:30]([OH:31])[CH2:32][CH2:33][CH3:34].[NH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[NH:1]([C:2](=[O:3])[CH3:4])[c:5]1[cH:6][cH:7][c:8]2[c:9]([CH2:16][c:17]3[cH:18][cH:19][n:20][cH:21][cH:22]3)[n:10][n:11][c:12]([Cl:15])[c:13]2[cH:14]1>>[ClH:15].[NH:1]([C:2](=[O:3])[CH3:4])[c:5]1[cH:6][cH:7][c:8]2[c:9]([CH2:16][c:17]3[cH:18][cH:19][n:20][cH:21][cH:22]3)[n:10][n:11][c:12]([NH:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[c:13]2[cH:14]1

Participants

5

Reactant 3

HCID 2631-ButanolHCID 6115AnilineHCID 227419517-Acetamino-1-chloro-4-(4-pyridylmethyl)phthalazine

Product 2

HCID 313Hydrochloric AcidHCID 22741995N-[4-anilino-1-(pyridin-4-ylmethyl)phthalazin-6-yl]acetamide

Sources & evidence

ORD record
ord-eab1e524d05942bb9ab64e75beec4d0c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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