3-Methylquinazolin-4-One
[CAS 2436-66-0]

Identification

• Name: 3-Methylquinazolin-4-One
• Synonyms: 3-Methyl-4-Quinazolinone; Nsc401251; 4(3H)-Quinazolinone, 3-Methyl-
• Molecular Formula: C₉H₈N₂O
• Molecular Weight: 160.18
• CAS Registry Number: 2436-66-0
• SMILES: C1=CC=CC2=C1C(=O)N(C)C=N2
• InChI: 1S/C9H8N2O/c1-11-6-10-8-5-3-2-4-7(8)9(11)12/h2-6H,1H3
• InChIKey: FJVAQPINJBFBLI-UHFFFAOYSA-N

Properties

• Density: 1.211g/cm³ (Cal.)
• Boiling point: 296.841°C at 760 mmHg (Cal.)
• Flash point: 133.325°C (Cal.)

References

• (1): Amit Nathubhai, Richard PattersonPresent address: Ascent Scientific Ltd (UK), Unit 3 Avon Riverside Estate, Victoria Road, Avonmouth, Bristol BS11 9DB, UK., Timothy J. Woodman, Harriet E. C. Sharp, Miranda T. Y. Chui, Hugo H. K. Chung, Stephanie W. S. Lau, Jun Zheng, Matthew D. Lloyd, Andrew S. Thompson and Michael D. Threadgill. N -Alkylation during formation of quinazolin-4-ones from condensation of anthranilamides and orthoamides, Org. Biomol. Chem., 2011, 9, 6089.