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Merck
CN

518727

3-Butynyl p-toluenesulfonate

96%

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About This Item

Linear Formula:
CH3C6H4SO3CH2CH2C≡CH
CAS Number:
Molecular Weight:
224.28
UNSPSC Code:
12352100
PubChem Substance ID:
MDL number:
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InChI

1S/C11H12O3S/c1-3-4-9-14-15(12,13)11-7-5-10(2)6-8-11/h1,5-8H,4,9H2,2H3

SMILES string

Cc1ccc(cc1)S(=O)(=O)OCCC#C

InChI key

STOASOOVVADOKH-UHFFFAOYSA-N

assay

96%

refractive index

n20/D 1.519 (lit.)

density

1.27 g/mL at 25 °C (lit.)

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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Dolores Pérez et al.
The Journal of organic chemistry, 61(5), 1650-1654 (1996-03-08)
Pharmacologically interesting lycorines were obtained by a short, efficient method based on an intramolecular Diels-Alder reaction between an alpha-pyrone and an alkyne, followed by loss of CO(2) in a retro Diels-Alder reaction. The cyclization precursors (pyrones 9) were obtained in
Sean C Turner et al.
Bioorganic & medicinal chemistry letters, 13(13), 2131-2135 (2003-06-12)
The synthesis and biological evaluation of novel cycloheptaquinoline antagonists of the human H(3) receptor are described. Two series of compounds, bearing either an amino substituent or an alkyne linker at the 11-position, were investigated. Modifications of the amino substituents, optimization
S A Glase et al.
Journal of medicinal chemistry, 39(16), 3179-3187 (1996-08-02)
A novel series of aryl 1-but-3-ynyl-4-phenyl-1,2,3,6-tetrahydropyridines with dopaminergic activity is described. The structure-activity relationships of this series were studied by synthesis of analogs and evaluation of their affinities for the dopamine (DA) D2 receptor and inhibition of locomotor activity (LMA)

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