Ethanethioic acid, S-(2-furanylmethyl) ester

Basic Information

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CAS Number

13678-68-7

Molecular Formula

C7H8O2S

Molecular Weight

156.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Boiling Point

90-92 °C/12 mmHg

Refractive Index

n20/D 1.526(lit.)

SMILES

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CC(=O)SCc1ccco1

InChI

InChI=1S/C7H8O2S/c1-6(8)10-5-7-3-2-4-9-7/h2-4H,5H2,1H3

InChIKey

LQOUTUIIYXYBQW-UHFFFAOYSA-N

LogP

2.0593

Topological Polar Surface Area

30.21 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

125

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 9 Class 9

Synonyms & References

English

Furfuryl thioacetate
Ethanethioic acid, S-(2-furanylmethyl) ester
S-Furfuryl thioacetate
2-Furfurylthiol Acetate
S-(furan-2-ylmethyl) ethanethioate
Thioacetic Acid S-Furfuryl Ester
FEMA 3162
Furfuryl tioacetate
Furfurylthiol acetate
S-FURFURYL ACETOTHIOATE
S-furfuryl ethanethioate
S-AcetylfurfurylMercaptan
Ethanethioic acid S-(2-furanylmethyl) ester
FURFURYL THIOACETATE 98+%
FURFURYL THIOACETATE
S-FURFURYL THIOACETATE

MDL Number

MFCD00010083

Customs Code

2932190090

FAQ

What is Ethanethioic acid, S-(2-furanylmethyl) ester (CAS: 13678-68-7)?

Ethanethioic acid, S-(2-furanylmethyl) ester is a chemical compound with the CAS number 13678-68-7. Its chemical formula is C6H6NO2S. This ester is characterized by its distinctive odor and is used in various applications due to its unique properties.

What are the main uses of Ethanethioic acid, S-(2-furanylmethyl) ester (CAS: 13678-68-7)?

Ethanethioic acid, S-(2-furanylmethyl) ester is primarily used in the pharmaceutical industry as a precursor for the synthesis of other compounds. It also finds applications in research and development for its unique chemical properties.

Is Ethanethioic acid, S-(2-furanylmethyl) ester (CAS: 13678-68-7) safe?

While Ethanethioic acid, S-(2-furanylmethyl) ester is generally safe under normal handling conditions, it is important to follow all safety guidelines. It is slightly toxic and should be handled with care. Protective gloves and goggles are recommended when working with it. Ensure proper ventilation and avoid contact with skin and eyes.

How should Ethanethioic acid, S-(2-furanylmethyl) ester (CAS: 13678-68-7) be stored?

Ethanethioic acid, S-(2-furanylmethyl) ester should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. Storage conditions should be maintained at a temperature below 25°C and with a relative humidity of less than 50%. Handle with care to avoid spillage and ensure proper disposal of any waste according to local regulations.