Ethyl 2-(4-(cyclopropylthio)phenyl)-2-oxoacetate

Basic Information

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CAS Number

745052-94-2

Molecular Formula

C13H14O3S

Molecular Weight

250.32 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

383.273°C at 760 mmHg

Density

1.24

SMILES

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CCOC(=O)C(=O)C1=CC=C(C=C1)SC2CC2

InChI

InChI=1S/C13H14O3S/c1-2-16-13(15)12(14)9-3-5-10(6-4-9)17-11-7-8-11/h3-6,11H,2,7-8H2,1H3

InChIKey

WSHDLDNMLDZRHC-UHFFFAOYSA-N

LogP

2.6869000000000014

Topological Polar Surface Area

43.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

291

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

AKOS015919140
WSHDLDNMLDZRHC-UHFFFAOYSA-N
A9541
745052-94-2
ethyl (4-cyclopropylsulfanylphenyl)oxoacetate
ethyl (4-cyclopropylsulfanylphenyl)-oxoacetate
SCHEMBL185319
ethyl 2-(4-cyclopropylsulfanylphenyl)-2-oxoacetate
DTXSID10676816
ethyl(4-cyclopropylsulfanylphenyl)oxoacetate
FT-0659873
ethyl [4-(cyclopropylsulfanyl)phenyl](oxo)acetate
(4-cyclopropylsulfanyl-phenyl)-oxo-acetic acid ethyl ester
ethyl 2-(4-(cyclopropylthio)phenyl)-2-oxoacetate
METHYL4-(METHYLTHIO)-6-OXO-2-PHENYL-1,6-DIHYDROPYRIMIDINE-5-CARBOXYLATE
ethyl2-(4-(cyclopropylthio)phenyl)-2-oxoacetate
Ethyl2-[4-(Cyclopropylsulfanyl)phenyl]-2-Oxoacetate
ethyl[4-(cyclopropylsulfanyl)phenyl](oxo)acetate
Ethyl 2-(4-(cyclopropylthio)phenyl)-2-oxoacetate
(4-cyclopropylsulfanyl-phenyl)oxoacetic acid ethyl ester
[(4-cyclopropylthio)phenyl]oxoacetic acid ethyl ester
AK102665
ANW-65512
CTK8C0948
SBB069242
SureCN185319

MDL Number

MFCD15071421

FAQ

What is Ethyl 2-(4-(cyclopropylthio)phenyl)-2-oxoacetate (CAS: 745052-94-2)?

Ethyl 2-(4-(cyclopropylthio)phenyl)-2-oxoacetate (CAS: 745052-94-2) is a chemical compound used in pharmaceutical and chemical manufacturing processes. It is an ester compound with a specific structure that includes a cyclopropylthio group and a phenyl group, and it is known for its unique chemical properties and potential applications.

What are the main uses of Ethyl 2-(4-(cyclopropylthio)phenyl)-2-oxoacetate (CAS: 745052-94-2)?

Ethyl 2-(4-(cyclopropylthio)phenyl)-2-oxoacetate (CAS: 745052-94-2) is primarily used in the synthesis of other compounds and as a reagent in organic chemistry. It finds applications in pharmaceuticals, where it may be used as an intermediate in drug development, and in the chemical industry for various organic synthesis processes.

Is Ethyl 2-(4-(cyclopropylthio)phenyl)-2-oxoacetate (CAS: 745052-94-2) safe?

Ethyl 2-(4-(cyclopropylthio)phenyl)-2-oxoacetate (CAS: 745052-94-2) is generally considered safe for its intended use, but proper handling and safety precautions must be followed. Wear appropriate personal protective equipment and ensure good ventilation during use. Avoid contact with skin and eyes, and store in a cool, dry place away from heat sources.

How should Ethyl 2-(4-(cyclopropylthio)phenyl)-2-oxoacetate (CAS: 745052-94-2) be stored?

Ethyl 2-(4-(cyclopropylthio)phenyl)-2-oxoacetate (CAS: 745052-94-2) should be stored in a tightly sealed container at room temperature, away from direct sunlight and heat sources. Maintain a cool, dry environment and avoid exposure to moisture. Ensure proper labeling and keep the storage area well-ventilated.