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Merck
CN

416738

S-tert-Butyl thioacetate

98%

Synonym(s):

1-(tert-Butylsulfanyl)ethan-1-one, S-(1,1-Dimethylethyl) ethanethioate

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About This Item

Linear Formula:
CH3COSC(CH3)3
CAS Number:
999-90-6
Molecular Weight:
132.22
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24865924
MDL number:
MFCD00042941
Beilstein/REAXYS Number:
1740436
Assay:
98%
Form:
liquid

Key Documents

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InChI

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

SMILES string

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

InChI key

PJFHXBBYLAVSLJ-UHFFFAOYSA-N

assay

98%

form

liquid

Quality Level

200

bp

135-136 °C (lit.)

density

0.927 g/mL at 25 °C (lit.)

functional group

thioester

Related Categories

General description

S-tert-Butyl thioacetate is a thioester.

Application

S-tert-Butyl thioacetate may be used for the preparation of vinyloxyborane derivative.

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

危险化学品
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Certificates of Analysis (COA)

Lot/Batch Number
0000234184
0000234184
0000217292
0000217292
0000210550

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Synthetic studies on an antitumor antibiotic, bleomycin. XIV. The synthesis of Boc-pyrimidoblamic acid.
M Otsuka et al.
Chemical & pharmaceutical bulletin, 33(2), 520-526 (1985-02-01)

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