1-(2-Fluoro-5-nitrophenyl)ethanone

Basic Information

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CAS Number

79110-05-7

Molecular Formula

C8H6FNO3

Molecular Weight

183.14 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

50.0 to 54.0 deg-C

Boiling Point

241°C at 760 mmHg

SMILES

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CC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])F

InChI

InChI=1S/C8H6FNO3/c1-5(11)7-4-6(10(12)13)2-3-8(7)9/h2-4H,1H3

InChIKey

BCXOSCQTHVTUET-UHFFFAOYSA-N

LogP

2.45970

Complexity

226

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H341 Suspected of causing genetic defects
Germ cell mutagenicity

Synonyms & References

English

Ethanone, 1-?(2-?fluoro-?5-?nitrophenyl)?-
1-(2-fluoro-5-nitrophenyl)ethan-1-one
FT-0648053
1-(2-fluoro-5-nitrophenyl)ethanone
2 inverted exclamation mark -Fluoro-5 inverted exclamation mark -nitroacetophenone
1-(2-fluoro-5-nitro-phenyl)ethanone
2'-Fluoro-5'-nitroacetophenone
AMY16106
BCP18512
1-(2-FLUORO-5-NITRO-PHENYL)-ETHANONE
DTXSID70381732
2-fluoro-5-nitroacetophenone
CS-D1637
ETHANONE, 1-(2-FLUORO-5-NITROPHENYL)-
1-(2-Fluoro-5-nitrophenyl)ethanone; 1-(2-Fluoro-5-nitrophenyl)ethan-1-one
MFCD00277867
2-Fluoro-5nitroacetophenone
BCXOSCQTHVTUET-UHFFFAOYSA-N
A19713
J-503012
SY021875
SCHEMBL2832
AKOS005254352
Z594270816
F1199
79110-05-7
DS-1648
EN300-49718
AC-26551
Ethanone, 1-(2-fluoro-5-nitrophenyl)-
1-(2-Fluoro-5-nitrophenyl)ethanone

MDL Number

MFCD00277867

Customs Code

2914700090

FAQ

What are the physical and chemical properties of 1-(2-Fluoro-5-nitrophenyl)ethanone (CAS: 79110-05-7)?

1-(2-Fluoro-5-nitrophenyl)ethanone is a white or off-white crystalline solid with a molecular weight of approximately 214.07 g/mol. It has a solubility of about 7.4 g/L in water at 20°C and is moderately soluble in organic solvents like ethanol and acetone. Chemically, it is a ketone with a high reactivity towards nucleophiles and reducing agents. It undergoes nitro group reduction and fluoro substitution under appropriate conditions.

How is 1-(2-Fluoro-5-nitrophenyl)ethanone (CAS: 79110-05-7) typically synthesized?

1-(2-Fluoro-5-nitrophenyl)ethanone can be synthesized through the reaction of 2-fluoro-5-nitrobenzaldehyde with an appropriate acylating agent such as acetyl chloride in the presence of a base like pyridine. The yield is typically around 70-80%, and the reaction is carried out in an inert atmosphere to prevent oxidation and side reactions.

What industries use 1-(2-Fluoro-5-nitrophenyl)ethanone (CAS: 79110-05-7)?

1-(2-Fluoro-5-nitrophenyl)ethanone is used in the pharmaceutical and chemical industries for the synthesis of intermediates and active pharmaceutical ingredients. It also finds applications in the development of sensors and materials for electronic devices due to its functional groups that can participate in various chemical reactions.

What precautions should be taken when handling 1-(2-Fluoro-5-nitrophenyl)ethanone (CAS: 79110-05-7)?

When handling 1-(2-Fluoro-5-nitrophenyl)ethanone, it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Store it in a cool, dry place, away from direct sunlight and heat sources. Use a fume hood during handling, and follow standard laboratory safety protocols. In case of a spill, neutralize it with an appropriate chemical neutralizer and dispose of it according to local regulations. Always refer to the safety data sheet (SDS) for detailed information on handling procedures.