1-(3,5-difluorophenyl)ethan-1-one

Basic Information

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CAS Number

123577-99-1

Molecular Formula

C8H6F2O

Molecular Weight

156.13 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 Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Melting Point

38.0 to 42.0 deg-C

Boiling Point

190.7℃/760mmHg

Refractive Index

1.4876

SMILES

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CC(=O)C1=CC(=CC(=C1)F)F

InChI

InChI=1S/C8H6F2O/c1-5(11)6-2-7(9)4-8(10)3-6/h2-4H,1H3

InChIKey

OXJLDNSPGPBDCP-UHFFFAOYSA-N

LogP

2.1673999999999998

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

148

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

1-(3,5-Difluorophenyl)ethanone
J-004956
3',5'-Difluoroacetophenone
CS-0015117
123577-99-1
3,5-di-fluoroacetophenone
1-(3,5-Difluorophenyl)ethanone #
3 inverted exclamation mark ,5 inverted exclamation mark -Difluoroacetophenone
1-(3,5-difluorophenyl)ethanone;3',5'-Difluoroacetophenone
FT-0614586
Ethanone, 1-(3,5-difluorophenyl)-
SCHEMBL319123
DTXSID90333793
1-(3,5-Difluorophenyl)Ethan-1-One
3',5'-Difluoroacetophenone, 97%
SY019254
MFCD00042489
AC-3617
AKOS005171588
Z838968642
D3425
EN300-60951
AM61302
CK2581
3,5-difluoro acetophenone
AB01921
3,5-Difluoroacetophenone
PS-8844
1-(3,5-difluoro-phenyl)-ethanone
3`,5`-difluoroacetophenone
3‘,5‘-Difluoroacetophenone

MDL Number

MFCD00042489

Customs Code

2914700090

FAQ

What is 1-(3,5-difluorophenyl)ethan-1-one (CAS: 123577-99-1)?

1-(3,5-difluorophenyl)ethan-1-one, also known as 1-(3,5-difluorophenyl)acetone, is a colorless to light yellow liquid with a molecular formula of C9H6F2O. It is flammable and has a boiling point of 134.5°C. This compound is used in pharmaceuticals and as a precursor in organic synthesis.

What are the main uses of 1-(3,5-difluorophenyl)ethan-1-one (CAS: 123577-99-1)?

1-(3,5-difluorophenyl)ethan-1-one is primarily used in the pharmaceutical industry as an intermediate for the synthesis of various drugs. It also serves as a precursor in organic synthesis for the production of other organic compounds.

Is 1-(3,5-difluorophenyl)ethan-1-one (CAS: 123577-99-1) safe?

1-(3,5-difluorophenyl)ethan-1-one is generally considered safe when handled with appropriate precautions. It is important to follow safety guidelines, including proper ventilation and the use of personal protective equipment (PPE) such as gloves and goggles. Exposure may cause irritation. Avoid contact with eyes and skin.

How should 1-(3,5-difluorophenyl)ethan-1-one (CAS: 123577-99-1) be stored?

1-(3,5-difluorophenyl)ethan-1-one should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent evaporation. Store it at room temperature (15-25°C) and avoid exposure to temperatures above 30°C. Maintain a relative humidity below 50% to prevent product degradation.