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CAS Number: 19181-53-4
6-methylquinazolin-4(1H)-one

Structure

6-methylquinazolin-4(1H)-one
Name: 6-methylquinazolin-4(1H)-one
Synonyms:
General Information
Product Number: 19181534

CAS Registry Number 19181-53-4
Name:
4(3H)?-?Quinazolinone, 6-?methyl-
4(1H)-Quinazolinone, 6-methyl- (9CI)
6-Methyl-4(3H)-quinazolinone
4-Hydroxy-6-methylquinazoline
6-Methyl-3H-quinazolin-4-one
6-Methyl-4-quinazolone

 

Chemical Formula: C9H8N2O
Exact Mass: 160.06
Molecular Weight: 160.17
m/z: 160.06 (100.0%), 161.07 (9.9%)

 

InChI:InChI=1S/C9H8N2O/c1-6-2-3-8-7(4-6)9(12)11-5-10-8/h2-5H,1H3,(H,10,11,12)

InChI Key:JUCDXPIFJIVICL-UHFFFAOYSA-N

Canonical SMILES:CC1=CC2=C(C=C1)NC=NC2=O

 

Thermal Properties Value Condition Note
Melting Point 260-261 °C Solv: ethanol (64-17-5) (4)IC
Melting Point 256 °C   (3)CAS
Melting Point 250-251 °C   (5)CAS
Melting Point 250 °C   (3)CAS

Specification

98%

References
  1. (3) Oerfi, Laszlo; Current Medicinal Chemistry 2004, V11(19), P2549-2553 CAPLUS
  2. (4) Jones, Terence R.; Journal of Medicinal Chemistry 1989, V32(4), P847-52 CAPLUS
  3. (5) Maillard, Jacques; US 3047462 1962 CAPLUS
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