(S)-(+)-1-METHYLPROPYL 4-METHYLBENZENESULFONATE

Modify Date: 2025-08-25 14:32:45

(S)-(+)-1-METHYLPROPYL 4-METHYLBENZENESULFONATE Structure
(S)-(+)-1-METHYLPROPYL 4-METHYLBENZENESULFONATE structure
Common Name (S)-(+)-1-METHYLPROPYL 4-METHYLBENZENESULFONATE
CAS Number 50896-54-3 Molecular Weight 228.30800
Density 1.12g/cm3 Boiling Point 329.1ºC at 760mmHg
Molecular Formula C11H16O3S Melting Point N/A
MSDS N/A Flash Point 152.8ºC

 Names

Name [(2S)-butan-2-yl] 4-methylbenzenesulfonate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.12g/cm3
Boiling Point 329.1ºC at 760mmHg
Molecular Formula C11H16O3S
Molecular Weight 228.30800
Flash Point 152.8ºC
Exact Mass 228.08200
PSA 51.75000
LogP 3.57960
Index of Refraction n20/D 1.504(lit.)
InChIKey AYHWQTQILBGWRN-JTQLQIEISA-N
SMILES CCC(C)OS(=O)(=O)c1ccc(C)cc1

 Safety Information

Hazard Codes C
Risk Phrases R34
Safety Phrases S26-S27-S36-S37-S39
RIDADR UN 1760 8/PG 3
WGK Germany 3
HS Code 2905199090

 Synthetic Route

~10%

(S)-(+)-1-METHYLPROPYL 4-METHYLBENZENESULFONATE Structure

(S)-(+)-1-METHY...

CAS#:50896-54-3

Literature: Shi, Wei; Nacev, Benjamin A.; Bhat, Shridhar; Liu, Jun O. ACS Medicinal Chemistry Letters, 2010 , vol. 1, # 4 p. 155 - 159

~0%

Detail
Literature: The Penn State Research Foundation Patent: US5591848 A1, 1997 ;

 Customs

HS Code 2905199090
Summary 2905199090. saturated monohydric alcohols. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

 Synonyms

(S)-sec-butyl p-toluenesulfonate
I09-0747
(S)-1-methylpropyl toluene-p-sulphonate
(S)-(+)-2-butyl tosylate
(S)-sec-butyl 4-methylbenzenesulfonate
(+)-(S)-(Butan-2-yl)-toluol-4-sulfonat
MFCD03093937
(S)-(+)-1-methylpropyl p-toluenesulfonate
(S)-(+)-1-Methylpropyl 4-methylbenzenesulfonate
(S)-butan-2-yl p-toluenesulfonate
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