4-(4-Oxo-3,4-dihydroquinazolin-2-yl)butanoic acid

• Catalog Number: ACMA00001037
• Category: Amines
• Molecular Weight: 232.24
• Molecular Formula: C₁₂H₁₂N₂
• Hazard Statements: H302-H318
• RIDADR: NONH for all modes of transport
• Symbol: GHS05

Custom Q&A

What is the molecular formula of the compound represented by PubChem CID 135406772?

The molecular formula is C12H12N2O3.

When was the compound first created in the database?

The compound was first created in the database on January 15, 2019.

What is the computed IUPAC name of the compound?

The computed IUPAC name is 4-(4-oxo-3H-quinazolin-2-yl)butanoic acid.

What is the InChIKey for the compound?

The InChIKey is IWUFDMAFCDCNMQ-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound have?

The compound has 2 hydrogen bond donor counts.

What is the exact mass of the compound?

The exact mass is 232.08479225 g/mol.

What is the heavy atom count for the compound?

The heavy atom count is 17.

Is the compound's canonical form Yes?

Yes, the compound's canonical form is Yes.

What is the topological polar surface area of the compound?

The topological polar surface area is 78.8 Ų.

What is the formal charge of the compound?

The formal charge is 0.