1-(4-Chlorophenyl)-2-cyclopropyl-1-propanone

Basic Information

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CAS Number

123989-29-7

Molecular Formula

C12H13ClO

Molecular Weight

208.69 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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CC(C1CC1)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H13ClO/c1-8(9-2-3-9)12(14)10-4-6-11(13)7-5-10/h4-9H,2-3H2,1H3

InChIKey

LRWCURGZPQWMRG-UHFFFAOYSA-N

LogP

3.568800000000002

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

214

Synonyms & References

English

A850838
EC 602-964-3
AS-66860
I10736
123989-29-7
1-(4-Chlorophenyl)-2-Cyclopropylpropanon-1
MFCD09951835
NS00002630
1-(4-chlorophenyl)-2-cyclopropyl-propan-1-one
1-(4-CHLOROPHENYL)-2-CYCLOPROPYLPROPAN-1-ONE
1-Propanone, 1-(4-chlorophenyl)-2-cyclopropyl-
SCHEMBL868012
1-(4-chlorophenyl)-2-cyclopropylpropan-1-one (BBT)
LRWCURGZPQWMRG-UHFFFAOYSA-N
AKOS015911006
DTXSID10542027
1-(4-Chlorophenyl)-2-cyclopropylpropan-1-one
1-(4-chlorophenyl)-2-cyclopropylpropanon-1-acetone
1-(4-chlorophenyl)-2-cyclopropylpropanone
1-Propanone,1-(4-chlorophenyl)-2-cyclopropyl
1-(4-chlorophenyl)-2-cyclopropyl-1-propanone
1-Propanone, 1-(4-chlorophenyl)-2-cyclopropyl-

MDL Number

MFCD09951835

Customs Code

2914700090

FAQ

What are the physical and chemical properties of 1-(4-Chlorophenyl)-2-cyclopropyl-1-propanone (CAS: 123989-29-7)?

1-(4-Chlorophenyl)-2-cyclopropyl-1-propanone is a white crystalline powder with a molecular weight of approximately 222.6 g/mol. It has a low water solubility and is soluble in organic solvents such as acetone and dichloromethane. The compound is known for its good reactivity in ketone chemistry and can undergo various transformations in the presence of appropriate reagents.

How is 1-(4-Chlorophenyl)-2-cyclopropyl-1-propanone (CAS: 123989-29-7) typically synthesized?

1-(4-Chlorophenyl)-2-cyclopropyl-1-propanone can be synthesized via a Claisen-Schmidt condensation between 4-chlorobenzaldehyde and cyclopropylmethyl ketone. The reaction is typically catalyzed by a base such as sodium hydroxide, and the product is isolated by recrystallization. The yield can be up to 80% with high selectivity.

What industries use 1-(4-Chlorophenyl)-2-cyclopropyl-1-propanone (CAS: 123989-29-7)?

1-(4-Chlorophenyl)-2-cyclopropyl-1-propanone finds applications in the pharmaceutical industry, where it is used as an intermediate in the synthesis of certain drugs. It is also utilized in the polymer industry for the development of new materials and in the chemical sensors sector for gas detection applications.

What precautions should be taken when handling 1-(4-Chlorophenyl)-2-cyclopropyl-1-propanone (CAS: 123989-29-7)?

When handling 1-(4-Chlorophenyl)-2-cyclopropyl-1-propanone, it is essential to use appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. Spills should be handled in a fume hood using a suitable absorbent material. This compound may irritate the skin and eyes, so immediate washing with water is recommended if contact occurs. Always refer to the Safety Data Sheet (SDS) for detailed safety information.