1-(3,5-Dichlorophenyl)propan-1-one

Basic Information

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CAS Number

92821-92-6

Molecular Formula

C9H8Cl2O

Molecular Weight

203.07 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

299 ºC

Density

1.258

Flash Point

125 ºC

SMILES

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CCC(=O)C1=CC(=CC(=C1)Cl)Cl

InChI

InChI=1S/C9H8Cl2O/c1-2-9(12)6-3-7(10)5-8(11)4-6/h3-5H,2H2,1H3

InChIKey

KFXWPKDEAPLDKF-UHFFFAOYSA-N

LogP

3.586100000000002

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

160

Synonyms & References

English

1-(3,5-Dichlorophenyl)propan-1-one
3,5-Dichloropropiophenone
3',5'-Dichloropropiophenone
1-(3,5-Dichloro-phenyl)-propan-1-one
1-Propanone, 1-(3,5-dichlorophenyl)-
KFXWPKDEAPLDKF-UHFFFAOYSA-N
CM11250
AS05238
AK137073
X3472
1-(3,5-DICHLOROPHENYL)-1-PROPANONE
1-(3,5-Dichlorophenyl)-1-propanone (ACI)
SCHEMBL633305
AKOS022171466
SB39994
DTXSID50659289
CS-0035633
DS-5664
A856384
EN300-1236424
92821-92-6

MDL Number

MFCD11617650

FAQ

What regulatory guidelines apply to 1-(3,5-Dichlorophenyl)propan-1-one (CAS: 92821-92-6)?

1-(3,5-Dichlorophenyl)propan-1-one (CAS: 92821-92-6) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH (Registration, Evaluation, Authorization, and Restriction of Chemicals) in the EU, and FDA/EPA requirements in the USA. It is classified as a hazardous chemical due to its potential for skin irritation and possible carcinogenicity.

Are there alternatives to 1-(3,5-Dichlorophenyl)propan-1-one (CAS: 92821-92-6) in synthesis?

Alternatives to 1-(3,5-Dichlorophenyl)propan-1-one (CAS: 92821-92-6) include other chloroanilines, such as 2-chloro-1-(m-chlorophenyl)ethan-1-one, which can be used as precursors in similar synthetic pathways. Isomeric compounds and analogs like 1-(4-chlorophenyl)propan-1-one are also considered in some applications.

What is the market or research trend for 1-(3,5-Dichlorophenyl)propan-1-one (CAS: 92821-92-6)?

The market for 1-(3,5-Dichlorophenyl)propan-1-one (CAS: 92821-92-6) is influenced by its use in pharmaceuticals and agrochemicals. Research trends focus on optimizing synthesis methods and exploring its potential as a bioisostere in drug design. Market dynamics indicate steady demand with price stability, driven by consistent industrial and medical applications.

How should waste containing 1-(3,5-Dichlorophenyl)propan-1-one (CAS: 92821-92-6) be handled?

Waste containing 1-(3,5-Dichlorophenyl)propan-1-one (CAS: 92821-92-6) should be collected in leak-proof containers and stored in a well-ventilated area. Disposal should be conducted by a professional waste management company that complies with local regulations. Environmental protection measures include neutralizing acidic or basic residues before disposal to prevent environmental contamination.