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88625

S-tert-Butyl thioacetate

purum, ≥98.0% (GC)

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About This Item

Linear Formula:
CH3COSC(CH3)3
CAS Number:
999-90-6
Molecular Weight:
132.22
PubChem Substance ID:
329769665
UNSPSC Code:
12352100
Beilstein/REAXYS Number:
1740436
MDL number:
MFCD00042941
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grade

purum

assay

≥98.0% (GC)

refractive index

n20/D 1.453

bp

135-136 °C (lit.)

density

0.927 g/mL at 25 °C (lit.)

SMILES string

CC(=O)SC(C)(C)C

InChI

1S/C6H12OS/c1-5(7)8-6(2,3)4/h1-4H3

InChI key

PJFHXBBYLAVSLJ-UHFFFAOYSA-N

Other Notes

The lithium enolate of S-t-butyl thioacetate adds to α,β-unsaturated ketones in the β-position

pictograms

Flame
GHS02

signalword

Warning

hcodes

H226

Hazard Classifications

Flam. Liq. 3

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

93.2 °F - closed cup

flash_point_c

34 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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H. Gerlach et al.
Helvetica Chimica Acta, 61, 2503-2503 (1978)