Water → 1-Butanol, 2-methyl-, 1-(4-methylbenzenesulfonate)

HRID 137013

Reaction equation

HRID 137013 reaction equation
[CH3:7][CH:8]([CH2:9][OH:10])[CH2:11][CH3:12].[OH2:24].[c:13]1([CH3:23])[cH:14][cH:15][c:16]([S:19](=[O:20])(=[O:21])[Cl:22])[cH:17][cH:18]1.[cH:1]1[cH:2][cH:3][n:4][cH:5][cH:6]1>>[CH3:7][CH:8]([CH2:9][O:10][S:19]([c:16]1[cH:15][cH:14][c:13]([CH3:23])[cH:18][cH:17]1)(=[O:20])=[O:21])[CH2:11][CH3:12]

Participants

5

Reactant 4

HCID 962WaterHCID 1049PyridineHCID 73974-Toluenesulfonyl chlorideHCID 87232-Methyl-1-butanol

Product 1

HCID 3011991-Butanol, 2-methyl-, 1-(4-methylbenzenesulfonate)

Sources & evidence

ORD record
ord-c8fc9d81a94a47f0a6a234b65a6acf2d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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