Bicarbonate Ion → (1-Chloropropyl)benzene

HRID 680735

Reaction equation

HRID 680735 reaction equation
[C:25](=[O:26])([OH:27])[O-:28].[CH2:11]([N:12]([CH:13]([CH3:14])[CH3:15])[CH:16]([CH3:17])[CH3:18])[CH3:19].[CH3:20][S:21]([Cl:22])(=[O:23])=[O:24].[Na+:29].[c:1]1([CH:7]([CH2:8][CH3:9])[OH:10])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([CH2:8][CH3:9])[Cl:22])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 71471-Phenyl-1-propanolHCID 31297Methanesulfonyl chlorideHCID 81531Diisopropylethylamine

Product 1

HCID 524241(1-Chloropropyl)benzene

Sources & evidence

ORD record
ord-b3e145479ef44622afbd37bfb251f98e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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