1-(5-Pyrimidinyl)ethanone

Basic Information

View in Editor

CAS Number

10325-70-9

Molecular Formula

C6H6N2O

Molecular Weight

122.13 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

Flash Point

92.1℃

SMILES

View in Editor

CC(=O)C1=CN=CN=C1

InChI

InChI=1S/C6H6N2O/c1-5(9)6-2-7-4-8-3-6/h2-4H,1H3

InChIKey

COTYNDRSENVEFI-UHFFFAOYSA-N

LogP

0.6792

Topological Polar Surface Area

42.85 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

108

Synonyms & References

English

AKOS011779966
Ethanone, 1-(5-pyrimidinyl)-
PB20327
J-503442
EN300-80488
1-pyrimidin-5-ylethanone
PS-4755
CS-D0295
SY005489
SCHEMBL1640391
FT-0602148
Z992240312
MFCD09038477
DTXSID60341325
1-(pyrimidin-5-yl)ethanone;5-Acetylpyrimidine
ETHYL4-CHLOROTHIENO[2,3-B]PYRIDINE-5-CARBOXYLATE
1-(Pyrimidin-5-yl)ethan-1-one
10325-70-9
1-(5-Pyrimidinyl)ethanone #
5-Acetylpyrimidine
AC-6900
1-(5-Pyrimidinyl)ethanone
1-(pyrimidin-5-yl)ethanone
Q63392382
Ethanone,1-(5-pyrimidinyl)-
Ethanone, 1-(5-pyrimidinyl)- (9CI)
5-acetylpyrimidine
Ketone,methyl 5-pyrimidinyl (7CI,8CI)
COTYNDRSENVEFI-UHFFFAOYSA-N
1-(5-pyrimidinyl)-ethanone
5-ethanoylpyrimidine

MDL Number

MFCD09038477

Customs Code

2933599090

FAQ

What are the physical and chemical properties of 1-(5-Pyrimidinyl)ethanone (CAS: 10325-70-9)?

1-(5-Pyrimidinyl)ethanone (CAS: 10325-70-9) is a white crystalline solid with a molecular weight of approximately 145.14 g/mol. It is slightly soluble in water and has good solubility in organic solvents such as ethanol and acetone. Chemically, it is highly reactive, showing strong reactivity towards nucleophiles and electrophiles, making it useful in various organic synthesis reactions.

How is 1-(5-Pyrimidinyl)ethanone (CAS: 10325-70-9) typically synthesized?

1-(5-Pyrimidinyl)ethanone (CAS: 10325-70-9) is typically synthesized via a condensation reaction between ethyl acetoacetate and 5-chloropyrimidine. The reaction is performed in a polar aprotic solvent such as acetonitrile, and a strong base such as potassium hydroxide is used as a catalyst. The product is obtained with a yield of around 70-80%.

What industries use 1-(5-Pyrimidinyl)ethanone (CAS: 10325-70-9)?

1-(5-Pyrimidinyl)ethanone (CAS: 10325-70-9) is primarily used in the pharmaceutical industry for the synthesis of various medicinal compounds. It is also utilized in the polymer industry for the preparation of certain types of polymers, and in the semiconductor industry as a precursor for organic thin films. Additionally, it has applications in the production of sensors and other electronic devices.

What precautions should be taken when handling 1-(5-Pyrimidinyl)ethanone (CAS: 10325-70-9)?

When handling 1-(5-Pyrimidinyl)ethanone (CAS: 10325-70-9), it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The substance should be handled in a well-ventilated area or a fume hood to prevent inhalation. Spills should be cleaned up immediately using appropriate absorbent materials, and the area should be well-ventilated. It is recommended to consult the safety data sheet (SDS) for detailed handling and disposal information.