Ethyl 4-oxo-1,4-dihydro-2-quinazolinecarboxylate

Basic Information

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CAS Number

29113-33-5

Molecular Formula

C11H10N2O3

Molecular Weight

218.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

White to Almost white

Melting Point

189-193 °C

Boiling Point

363.7±25.0 °C(Predicted)

Density

1.34±0.1 g/cm3(Predicted)

Flash Point

173.8℃

Refractive Index

1.622

SMILES

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CCOC(=O)C1=NC2=CC=CC=C2C(=O)N1

InChI

InChI=1S/C11H10N2O3/c1-2-16-11(15)9-12-8-6-4-3-5-7(8)10(14)13-9/h3-6H,2H2,1H3,(H,12,13,14)

InChIKey

BMCAWNQKVVTNFP-UHFFFAOYSA-N

LogP

1.0997999999999999

pKa

-2.12±0.20(Predicted)

Topological Polar Surface Area

72.05 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

338

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

2-Quinazolinecarboxylic acid, 4-hydroxy-, ethyl ester
AE-641/14965163
Z56821553
ethyl 4-hydroxyquinazoline-2-carboxylate
ethyl 4-oxo-3,4-dihydroquinazoline-2-carboxylate
4-oxo-3H-quinazoline-2-carboxylic acid ethyl ester
ethyl 4-oxo-1H-quinazoline-2-carboxylate
AC-7202
MLS000774835
FT-0626103
Ethyl 4-quinazolone-2-carboxylate
4-Quinazolone-2-carboxylic acid ethyl ester
ethyl 4-oxo-1,4-dihydroquinazoline-2-carboxylate
4-Oxo-3,4-dihydro-quinazoline-2-carboxylic acid ethyl ester
BB 0240651
4-oxo-1H-quinazoline-2-carboxylic acid ethyl ester
SY005076
EN300-16910
SR-01000459303
F3099-5705
MFCD00051583
2-Quinazolinecarboxylic acid, 1,4-dihydro-4-oxo-, ethyl ester
SR-01000459303-1
NSC159700
HMS1399K08
Ethyl 3,4-dihydroquinazolin-4-one-2-carboxylate
A819770
ETHYL 4-HYDROXY-2-QUINAZOLINECARBOXYLATE
HMS2762O09
2-Quinazolinecarboxylicacid,3,4-dihydro-4-oxo-,ethyl ester
SMR000365483

MDL Number

MFCD00051583

Customs Code

2933599590

FAQ

What is Ethyl 4-oxo-1,4-dihydro-2-quinazolinecarboxylate (CAS: 29113-33-5)?

Ethyl 4-oxo-1,4-dihydro-2-quinazolinecarboxylate (CAS: 29113-33-5) is an organic compound used in pharmaceutical and chemical research. It is characterized by its unique structure and properties, making it an important intermediate in the synthesis of various drugs and materials.

What are the main uses of Ethyl 4-oxo-1,4-dihydro-2-quinazolinecarboxylate (CAS: 29113-33-5)?

The main uses of Ethyl 4-oxo-1,4-dihydro-2-quinazolinecarboxylate (CAS: 29113-33-5) include serving as a key intermediate in the pharmaceutical industry, particularly in the synthesis of novel drugs. It is also used in chemical research for developing new materials and compounds.

Is Ethyl 4-oxo-1,4-dihydro-2-quinazolinecarboxylate (CAS: 29113-33-5) safe?

Ethyl 4-oxo-1,4-dihydro-2-quinazolinecarboxylate (CAS: 29113-33-5) is generally safe when handled with appropriate precautions. It is important to follow safety guidelines, including the use of personal protective equipment and proper storage conditions to minimize risks.

How should Ethyl 4-oxo-1,4-dihydro-2-quinazolinecarboxylate (CAS: 29113-33-5) be stored?

Ethyl 4-oxo-1,4-dihydro-2-quinazolinecarboxylate (CAS: 29113-33-5) should be stored in a cool, dry place away from direct sunlight and moisture. It should be kept in a well-ventilated area and in a tightly sealed container to prevent degradation and ensure safety.