1-(2,4-Dichlorophenyl)-1-butanone

Basic Information

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CAS Number

66353-47-7

Molecular Formula

C10H10Cl2O

Molecular Weight

217.09 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

141°C/12mmHg

Density

1.230

Flash Point

116.849℃

Refractive Index

1.5410 to 1.5450

SMILES

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CCCC(=O)C1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C10H10Cl2O/c1-2-3-10(13)8-5-4-7(11)6-9(8)12/h4-6H,2-3H2,1H3

InChIKey

FXCJYMLJTUZGDU-UHFFFAOYSA-N

LogP

3.976200000000002

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

182

Synonyms & References

English

2',4'-Dichlorobutyrophenone
2,4-Dichlorophenyl Propyl Ketone
2 inverted exclamation mark ,4 inverted exclamation mark -Dichlorobutyrophenone
AS-31021
CS-0224136
AM20040981
D3468
AKOS010522895
FT-0641063
DTXSID10524848
66353-47-7
SY015391
2 inverted exclamation mark pound not4 inverted exclamation mark -Dichlorobutyrophenone
2,4-Dichloro butyrophenone
AC-8764
MFCD09028060
1-Butanone, 1-(2,4-dichlorophenyl)-
1-(2,4-dichlorophenyl)butan-1-one
FXCJYMLJTUZGDU-UHFFFAOYSA-N
Z802544640
EN300-117961
2`,4`-Dichlorobutyrophenone
SCHEMBL2125979
1-(2,4-Dichlorophenyl)butan-1-one
2,4-Dichlorobutyrophenone
2’,4’-Dichlorobutyrophenone
2,4-Dichlorophenylpropyl ketone
PubChem10583
2\\',4\\'-Dichlorobutyrophenone
EBD28079
ST24020978

MDL Number

MFCD09028060

Customs Code

2914700090

FAQ

What are the physical and chemical properties of 1-(2,4-Dichlorophenyl)-1-butanone (CAS: 66353-47-7)?

1-(2,4-Dichlorophenyl)-1-butanone (CAS: 66353-47-7) is a white crystalline solid with a molecular weight of approximately 246.06 g/mol. It has low solubility in water but is soluble in organic solvents like ethanol and acetone. This compound is moderately reactive and can undergo substitution reactions, particularly with nucleophiles.

How is 1-(2,4-Dichlorophenyl)-1-butanone (CAS: 66353-47-7) typically synthesized?

1-(2,4-Dichlorophenyl)-1-butanone (CAS: 66353-47-7) is typically synthesized via the condensation of 2,4-dichlorophenyl isocyanide with butanal. Commonly used catalysts include acetic acid or a Lewis acid like aluminum chloride. The reaction proceeds with good yield and stoichiometric selectivity.

What industries use 1-(2,4-Dichlorophenyl)-1-butanone (CAS: 66353-47-7)?

1-(2,4-Dichlorophenyl)-1-butanone (CAS: 66353-47-7) finds applications in the pharmaceutical industry for the synthesis of certain drug intermediates. It is also used in the polymer industry for the modification of polymers and in the electronics sector for semiconductor applications due to its aromatic and ketone functional groups.

What precautions should be taken when handling 1-(2,4-Dichlorophenyl)-1-butanone (CAS: 66353-47-7)?

When handling 1-(2,4-Dichlorophenyl)-1-butanone (CAS: 66353-47-7), ensure to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work in a well-ventilated area or fume hood to avoid inhalation. Spills should be cleaned up immediately using appropriate absorbents, and the area should be well-ventilated. Refer to the Safety Data Sheet (SDS) for detailed information on safe handling and disposal.