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CAS Number: 179688-53-0
7-methoxy-4-oxo-3,4-dihydroquinazolin-6-yl acetate

Structure

7-methoxy-4-oxo-3,4-dihydroquinazolin-6-yl acetate
Name: 7-methoxy-4-oxo-3,4-dihydroquinazolin-6-yl acetate
Synonyms:
General Information
Product Number: 179688530

CAS Registry Number: 179688-53-0

Name:

4(3H)​-​Quinazolinone, 6-​(acetyloxy)​-​7-​methoxy-
4(1H)​-​Quinazolinone, 6-​(acetyloxy)​-​7-​methoxy- (9CI); 3,​4-​Dihydro-​4-​oxo-​6-​acetoxy-​7-​methoxyquinazoline; 3,​4-​Dihydro-​4-​oxo-​6-​acetyloxy-​7-​methoxyquinazoline; 3,​4-​Dihydro-​7-​methoxy-​4-​oxoquinazolin-​6-​yl acetate; 6-​Acetoxy-​7-​methoxy-​3,​4-​dihydroquinazolin-​4-​one; 6-​Acetoxy-​7-​methoxyquinazolin-​4(3H)​-​one; 6-​Acetoxy-​7-​methoxyquinazolin-​4-​one; 7-​Methoxy-​4-​oxo-​3,​4-​dihydroquinazolin-​6-​yl acetate; Acetic acid 4-​hydroxy-​7-​methoxyquinazolin-​6-​yl ester 

 

Chemical Formula: C11H10N2O4
Exact Mass: 234.06
Molecular Weight: 234.21
m/z: 234.06 (100.0%), 235.07 (12.2%), 236.07 (1.5%)
Elemental Analysis: C, 56.41; H, 4.30; N, 11.96; O, 27.33

 

InChI: InChI=1S/C11H10N2O4/c1-6(14)17-10-3-7-8(4-9(10)16-2)12-5-13-11(7)15/h3-5H,1-2H3,(H,12,13,15)
InChIKey: SOLQIFINSOHAQD-UHFFFAOYSA-N
Canonical SMILES : CC(=O)OC1=C(C=C2C(=C1)C(=O)N=CN2)OC

 

Thermal Properties Value Condition Note
Melting Point 293 °C   (2)CAS

Specification

98%

References
  1. (1) Knesl, Petr; Molecules 2006, V11(4), P286-297 CAPLUS
  2. (2) Lueth, Anja; European Journal of Medicinal Chemistry 2008, V43(7), P1478-1488 CAPLUS
  3. (3) Tasler, Stefan; Bioorganic & Medicinal Chemistry 2009, V17(18), P6728-6737 CAPLUS
  4. (4) Harris, Craig S.; Tetrahedron Letters 2009, V50(14), P1600-1602 CAPLUS
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