S-butyl hydroxy(phenyl)ethanethioate

Base Information

• Chemical Name: S-butyl hydroxy(phenyl)ethanethioate
• CAS No.: 63860-13-9
• Molecular Formula: C12H16 O2 S
• Molecular Weight: 224.324

Synonyms:NSC238141; S-Butyl thiolmandelate

Chemical Property of S-butyl hydroxy(phenyl)ethanethioate

Chemical Property:

• Vapor Pressure: 2.19E-05mmHg at 25°C
• Boiling Point: 346.4°Cat760mmHg
• Flash Point: 163.3°C
• Density: 1.135g/cm³

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of S-butyl hydroxy(phenyl)ethanethioate

There total 3 articles about S-butyl hydroxy(phenyl)ethanethioate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

(Phenylglyoxal)-butylthiohalbacetal (16273-01-1) → S-butyl-2-hydroxy-2-phenylthioacetate (63860-13-9)

Guidance literature:

With 1,4-diaza-bicyclo[2.2.2]octane; In water; acetonitrile; at 30 ℃; Rate constant;

DOI:10.1246/bcsj.55.1493

Reference yield:

n-butanethiol (109-79-5) + phenylglyoxal hydrate (1074-12-0) → S-butyl-2-hydroxy-2-phenylthioacetate (63860-13-9)

Guidance literature:

Multistep reaction; (i) Mg(OAc)2, DMF, (ii) 2,6-lutidine;

DOI:10.1021/jm00220a002

Reference yield:

n-butanethiol (109-79-5) + MANDELIC ACID (611-71-2,611-72-3,17199-29-0,90-64-2) → S-butyl-2-hydroxy-2-phenylthioacetate (63860-13-9)

Guidance literature:

boric acid; at 30 ℃; Equilibrium constant; different pH's;

DOI:10.1021/jo00320a021

upstream raw materials:

n-butanethiol

phenylglyoxal hydrate

(Phenylglyoxal)-butylthiohalbacetal

MANDELIC ACID

Downstream raw materials:

n-butanethiol

MANDELIC ACID

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