2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid | CAS No. 99066-77-0

2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid

Basic Information

CAS Number

99066-77-0

Molecular Formula

C9H6N2O3

Molecular Weight

190.16 g/mol

AD

Basic Physical Properties

Boiling Point

561.5°C at 760 mmHg

Density

1.56

Flash Point

293.4°C

Refractive Index

1.71

C1=CC=C2C(=C1)C(=NC(=O)N2)C(=O)O

InChI

InChI=1S/C9H6N2O3/c12-8(13)7-5-3-1-2-4-6(5)10-9(14)11-7/h1-4H,(H,12,13)(H,10,11,14)

InChIKey

JMRRYHBZGAQICA-UHFFFAOYSA-N

LogP

0.6213

Topological Polar Surface Area

83.04999999999998 Ų

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

311

Safety Information

View Safety Information

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

  • AKOS001770443
  • carboxyquinazolinone
  • 99066-77-0
  • MFCD00578120
  • TJY
  • 2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid
  • 2-QUINAZOLONE-4-CARBOXYLIC ACID
  • AB06490
  • 2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid #
  • SCHEMBL14072437
  • AKOS006228481
  • Quinazoline-4-carboxylic acid, 1,2-dihydro-2-oxo-
  • 2-OXO-1,2-DIHYDRO-QUINAZOLINE-4-CARBOXYLIC ACID
  • 2-oxo-1,2-dihydroquinazoline-4-carboxylic acid
  • EN300-120846
  • DTXSID20337340
  • JMRRYHBZGAQICA-UHFFFAOYSA-N
  • 2-oxo-1,2-dihydroquinazoline-4-carboxylicacid
  • SCHEMBL3558607
  • AC-26857
  • 2-oxo-1H-quinazoline-4-carboxylic acid
  • FT-0682251
  • 2-Oxo-1,2-dihydroquinazoline-4-carboxylic acid
  • 4-Quinazolinecarboxylic acid, 1,2-dihydro-2-oxo-
  • 2-Hydroxy-chinazolin-4-carbonsaeure
  • 2-oxo-1,2-dihydroquinazoline-4-carboxylic acid(SALTDATA: H2O)
  • 2-oxohydroquinazoline-4-carboxylic acid
  • 2-oxoquinazoline-4-carboxylic acid
  • 4-Quinazolinecarboxylic acid,1,2-dihydro-2-oxo

MDL Number

MFCD00578120

Customs Code

2927000090

FAQ

What are the physical and chemical properties of 2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid (CAS: 99066-77-0)?

2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid has a crystalline form with a molecular weight of approximately 216.21 g/mol. It is slightly soluble in water and more soluble in organic solvents. The compound is moderately reactive and susceptible to hydrolysis under acidic conditions. It has a pKa of about 4.5, indicating its acidic nature.

How is 2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid (CAS: 99066-77-0) typically synthesized?

2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid is typically synthesized through the condensation of 4-aminobenzoyl chloride with 1,3-dicarbonyl compounds such as trimesic acid. The reaction involves the use of a catalyst like tin(II) chloride to enhance the yield. The process is selective and yields up to 85% of 2-oxo-1,2-dihydro-4-quinazolinecarboxylic acid.

What industries use 2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid (CAS: 99066-77-0)?

2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid is used in the pharmaceutical industry for the synthesis of certain drugs. It is also utilized in the polymer industry for the modification of materials. Additionally, it has applications in the development of sensors and semiconductors due to its unique chemical properties.

What precautions should be taken when handling 2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid (CAS: 99066-77-0)?

When handling 2-Oxo-1,2-dihydro-4-quinazolinecarboxylic acid, it is essential to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a laboratory coat. Work should be conducted in a well-ventilated area or fume hood. Spills should be cleaned up with appropriate absorbents, and the material safety data sheet (MSDS) should be readily available for reference.

Related Compounds

You might also like

Compound Q&A

What is 6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one (CAS: 21889-89-4)?

6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one is a cyclic ketone with a molecular for...

21889-89-46-Methyl-7-oxabicycl...
Compound Q&A

What is 4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid (CAS: 906353-00-2)?

4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid is a chemical compound with the CAS nu...

906353-00-24-[(6-Methyl-2-pyraz...
Compound Q&A

What is 2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8)?

2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8) is a colorless to slightly yel...

49745-42-82-(2-Pyridinyl)-1,3-...
Compound Q&A

What is 2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile (CAS: 24783-42-4)?

2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile is an organic compound with the CA...

24783-42-42-(6-Chloro-2-pyridi...
Compound Q&A

What is 2-Oxopropanamide (CAS: 631-66-3)?

2-Oxopropanamide, also known as 2-aminoacrylic acid, is a chemical compound with...

631-66-32-Oxopropanamide
Compound Q&A

What is 2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CAS: 1289040-88-5)?

2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CA...

1289040-88-52-Methyl-2-propanyl ...
Compound Q&A

What is NAMPT inhibitor-linker 1 (CAS: 2241019-57-6)?

NAMPT inhibitor-linker 1 (CAS: 2241019-57-6) is a chemical compound designed as ...

2241019-57-6NAMPT inhibitor-link...
Compound Q&A

What is (2-(2,2,2-Trifluoroacetyl)pyridin-4-yl)boronic acid (CAS: 1310404-58-0)?

It is a chemical compound with the structure (2-(2,2,2-Trifluoroacetyl)pyridin-4...

1310404-58-0(2-(2,2,2-Trifluoroa...
Compound Q&A

What is 1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (CAS: 794568-90-4)?

1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,...

794568-90-41-(2-Chlorophenyl)-6...
Compound Q&A

What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

Vinyl(chloromethyl)dimethoxysilane is an organosilicon compound with the molecul...

1314981-48-0Vinyl(chloromethyl)d...