Hydrochloric Acid → Picolyl chloride

HRID 206581

Reaction equation

HRID 206581 reaction equation
[CH3:44][OH:45].[ClH:34].[NH2:1][c:2]1[n:3][c:4]([CH2:21][O:22][CH3:23])[cH:5][cH:6][c:7]1-[c:8]1[cH:9][c:10]([CH2:13][c:14]2[cH:15][cH:16][c:17]([OH:20])[cH:18][cH:19]2)[n:11][o:12]1.[Na+:25].[OH-:24].[OH2:43].[c:26]1([CH2:32][Cl:33])[cH:27][cH:28][cH:29][cH:30][n:31]1.[c:35]1([CH2:41][Cl:42])[cH:36][cH:37][cH:38][cH:39][n:40]1>>[NH2:1][c:2]1[n:3][c:4]([CH2:21][O:22][CH3:23])[cH:5][cH:6][c:7]1-[c:8]1[cH:9][c:10]([CH2:13][c:14]2[cH:15][cH:16][c:17]([O:20][CH2:41][c:35]3[cH:36][cH:37][cH:38][cH:39][n:40]3)[cH:18][cH:19]2)[n:11][o:12]1.[c:26]1([CH2:32][Cl:33])[cH:27][cH:28][cH:29][cH:30][n:31]1

Participants

9

Reactant 7

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 23393Picolyl chloride2×HCID 592552174-(5-(2-Amino-6-methoxymethyl-pyridin-3-yl)isoxazol-3-ylmethyl)-phenol

Product 2

HCID 23393Picolyl chlorideHCID 592552866-Methoxymethyl-3-(3-(4-(pyridin-2-ylmethoxy)-benzyl)-isoxazol-5-yl)pyridin-2-ylamine

Sources & evidence

ORD record
ord-b2fdc4f4708148d39af59011de068cb5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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