5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one

Basic Information

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CAS Number

150322-38-6

Molecular Formula

C18H18FNO2S

Molecular Weight

331.41 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 Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

483.6℃ at 760mmHg

SMILES

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C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC4C(=CC(=O)S4)C3

InChI

InChI=1S/C18H18FNO2S/c19-14-4-2-1-3-13(14)17(18(22)11-5-6-11)20-8-7-15-12(10-20)9-16(21)23-15/h1-4,9,11,15,17H,5-8,10H2

InChIKey

MJAMUSZUMAHFLH-UHFFFAOYSA-N

LogP

3.120000000000002

Topological Polar Surface Area

37.38 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

545

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

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

Synonyms & References

English

BCP12275
150322-38-6
5-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-2H,4H,5H,6H,7H,7aH-thieno[3,2-c]pyridin-2-one
MJAMUSZUMAHFLH-UHFFFAOYSA-N
A884167
DTXSID00465251
5-(2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl)-5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one
Desacetylprasugrel
5-(alpha-cyclopropylcarbonyl-2-fluorobenzyl)-2-oxo-2,4,5,6,7,7a-hexahydro thieno[3,2-c] pyridine
Prasugrel desacetyl
DESACETYL PRASUGREL DIASTEREOMER 2 COMPONENT OF DESACETYL PRASUGREL
DESACETYL PRASUGREL
AKOS015899146
AC-25298
SCHEMBL13249023
1F19E6097Q
5-(alpha-cyclopropylcarbonyl-2-fluorobenzyl)-2-oxo-2,4,5,6,7,7a-hexahydrothieno[3,2-c]pyridine
Thieno[3,2-c]pyridin-2(4H)-one, 5-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7a-tetrahydro-
Thieno(3,2-C)pyridin-2(4H)-one, 5-(2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl)-5,6,7,7a-tetrahydro-
CS-0187058
DESACETYL PRASUGREL DIASTEREOMER 1 COMPONENT OF DESACETYL PRASUGREL
5-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7a-tetrahydro-thieno[3,2-c]pyridin-2(4h)-one
5-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2-one
DS-18458
AMY15276
5-(2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl)-5,6,7,7a-tetrahydrothieno(3,2-c)pyridin-2(4h)-one
SCHEMBL253435
Thieno[3,2-c]pyridin-2(4H)-one, 5-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7a-tetrahydro
UNII-1F19E6097Q
CHEMBL3526430
5-[2-cyclopropyl-1-(2-fluorphenyl)-2-oxoethyl]-5,6,7,7a-tetrahydro-4H-thieno[3,2-c]pyridine-2-on

MDL Number

MFCD00920409

Customs Code

2934999090

FAQ

What regulatory guidelines apply to 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one (CAS: 150322-38-6)?

The compound is subject to regulatory guidelines under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations, and FDA/EPA requirements. It should be classified and labeled according to its hazardous properties, such as flammability, reactivity, and toxicity. Manufacturers and importers must comply with REACH registration and reporting obligations. Additionally, it is important to follow local and national regulations regarding the handling, storage, and disposal of the compound.

Are there alternatives to 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one (CAS: 150322-38-6) in synthesis?

There are alternative reagents and synthetic approaches that can be used as substitutes in the synthesis of 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one. These include using different starting materials or employing different reaction conditions. Common alternatives include other pyridine derivatives, fluoro-substituted phenyl compounds, and cyclopropyl ketones. However, the choice of alternative will depend on the specific requirements of the synthesis and the desired product attributes.

What is the market or research trend for 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one (CAS: 150322-38-6)?

There is growing interest in the research and development of 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one due to its potential applications in pharmaceuticals and materials science. Market trends indicate increasing demand for novel chemical entities with specific pharmacological properties. Research is focused on understanding its biological activity, exploring its use in drug discovery, and investigating its synthetic methodologies. The compound is also being studied for its potential in the development of new materials with unique properties.

How should waste containing 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one (CAS: 150322-38-6) be handled?

Waste containing 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one should be managed according to hazardous waste regulations. Proper collection, labeling, and storage are essential to prevent environmental contamination. The waste should be incinerated or disposed of by a professional waste management company that specializes in chemical waste disposal. It is important to ensure that all safety precautions are followed, such as personal protective equipment and spill containment measures, to protect both human health and the environment.