1-(4-Pyridinyl)acetone

Basic Information

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CAS Number

6304-16-1

Molecular Formula

C8H9NO

Molecular Weight

135.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Physical State

YELLOW LIQUID

Melting Point

13°C

Boiling Point

80°C/0.3mmHg

Density

1.046

Water Solubility

Slightly soluble in water.

Flash Point

143℃/20mm

Refractive Index

1.519-1.5225

SMILES

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CC(=O)CC1=CC=NC=C1

InChI

InChI=1S/C8H9NO/c1-7(10)6-8-2-4-9-5-3-8/h2-5H,6H2,1H3

InChIKey

ILRVKOYYFFNXDB-UHFFFAOYSA-N

LogP

1.2131

Topological Polar Surface Area

29.96 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

116

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

Synonyms & References

English

SCHEMBL48403
(4-pyridinyl)methyl methyl ketone
TS-01741
DTXSID20212325
EINECS 228-605-7
4-Pyridinylacetone
R6ONM9F2AU
1-PYRIDIN-4-YL-2-OXO-PROPANE
1-(4-Pyridinyl)acetone #
CS-W002401
NSC-42613
NSC 42613
1-pyridin-4-ylpropan-2-one
1-pyridin-4-yl-2-propanone
SY002437
4-Acetonylpyridine
1-(4-Pyridyl)acetone
6304-16-1
4-pyridylacetone
METHYL 4-PYRIDYLMETHYL KETONE
AKOS009097741
2-PROPANONE, (4-PYRIDYL)-
4-Pyridyl acetone
2-PROPANONE, 1-(4-PYRIDYL)-
AC-19864
J-503620
BCP13413
DS-1184
1-(4-Pyridinyl)acetone
1-(4-Pyridyl)-2-acetone
F0001-1710

MDL Number

MFCD00129043

Customs Code

2933399090

FAQ

What regulatory guidelines apply to 1-(4-Pyridinyl)acetone (CAS: 6304-16-1)?

1-(4-Pyridinyl)acetone (CAS: 6304-16-1) is classified under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) as a flammable liquid and requires appropriate hazard communication labels. In Europe, it falls under REACH regulations, which may require registration if produced or imported above a certain tonnage. The FDA and EPA may also have specific requirements for its use in pharmaceutical and industrial applications, including documentation and storage conditions.

Are there alternatives to 1-(4-Pyridinyl)acetone (CAS: 6304-16-1) in synthesis?

Several alternatives can be used in the synthesis of 1-(4-Pyridinyl)acetone (CAS: 6304-16-1), such as acetophenone and pyridine derivatives. Other similar compounds include 2-(4-pyridinyl)-2-propanone and 4-(pyridin-4-yl)acetone. These alternatives may offer similar reactivity but with different physical and chemical properties, making them suitable for specific applications.

What is the market or research trend for 1-(4-Pyridinyl)acetone (CAS: 6304-16-1)?

The market for 1-(4-Pyridinyl)acetone (CAS: 6304-16-1) is growing due to its use in pharmaceuticals, agrochemicals, and as a precursor in organic synthesis. Research trends indicate increased interest in its use as a chiral auxiliary and in the development of new synthetic routes. The market is expected to expand with ongoing advancements in drug discovery and chemical manufacturing processes.

How should waste containing 1-(4-Pyridinyl)acetone (CAS: 6304-16-1) be handled?

Waste containing 1-(4-Pyridinyl)acetone (CAS: 6304-16-1) should be collected in suitable containers and stored away from heat and ignition sources. It should be disposed of according to local regulations and may require incineration or professional chemical waste disposal services. Always follow safety precautions and ensure proper labeling and documentation to comply with environmental protection requirements.